SCHEMBL4751430

SCHEMBL4751430

CC(=S)c1nn(-c2c(Cl)cc(C(F)(F)F)cc2Cl)c(N)c1[S+]([O-])C(F)(F)F

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GABRP O00591 20/20 0.53
GABRD O14764 20/20 0.53
GABRA1 P14867 20/20 0.53
GABRB1 P18505 20/20 0.53
GABRG2 P18507 20/20 0.53
GABRB3 P28472 20/20 0.53
GABRA5 P31644 20/20 0.53
GABRA3 P34903 20/20 0.53
GABRA2 P47869 20/20 0.53
GABRB2 P47870 20/20 0.53
GABRA4 P48169 20/20 0.53
GABRE P78334 20/20 0.53
GABRA6 Q16445 20/20 0.53
GABRG1 Q8N1C3 20/20 0.53
GABRG3 Q99928 20/20 0.53
GABRQ Q9UN88 20/20 0.53

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL33214 0.91 GABRP (0.52) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL1107821 0.90 GABRP (0.51) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL20089290 0.89 GABRP (0.53) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL4797885 0.87 GABRP (0.48) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL18393472 0.85 GABRA2 (0.56) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7779071 0.85 GABRP (0.51) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7023353 0.84 GABRP (0.50) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7642264 0.84 GABRP (0.50) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7028353 0.83 GABRP (0.49) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7616471 0.83 GABRP (0.49) GABRPGABRDGABRA1GABRB1GABRG2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 53 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9901093-B2 Microemulsion having wide application range BASF SE (DE) 2018-02-27 US disclosed
US-9888685-B2 Pesticidal mixtures comprising cyanosulfoximine compounds BASF SE (DE) 2018-02-13 US disclosed
US-20180007904-A1 Pesticidal Active Mixtures Comprising Isoxazoline Compounds I BASF SE (DE) 2018-01-11 US disclosed
US-20180007908-A1 Pesticidal Mixtures BASF SE (DE) 2018-01-11 US disclosed
US-9770029-B2 Pesticidal active mixtures comprising isoxazoline compounds I BASF SE (DE) 2017-09-26 US disclosed
US-9615503-B2 Method for cultivating sugar cane BASF SE (DE) 2017-04-11 US disclosed
US-20170042156-A1 Pesticidal Active Mixtures Comprising Isoxazoline Compounds I BASF SE (DE) 2017-02-16 US disclosed
US-9522970-B2 Comb polymers and use thereof for the production of active or effective ingredient formulations BASF SE (DE) 2016-12-20 US disclosed
US-9462804-B2 Agrochemical formulations comprising co-polymers based on ethylenically unsaturated dicarboxylic mono and diesters BASF SE (DE) 2016-10-11 US disclosed
US-20160007609-A1 Pesticidal Mixtures BASF SE (DE) 2016-01-14 US disclosed
US-20110160054-A1 Pesticidal Mixtures Comprising Cyanosulfoximine Compounds and Spinetoram BASF SE (DE) 2011-06-30 US disclosed
US-20110118212-A1 Pestcidal active mixtures comprising isoxazoline compounds I BASF SE (DE) 2011-05-19 US disclosed
US-20110105321-A1 Pesticidal Mixtures Comprising Cyanosulfoximine Compounds BASF SE (DE) 2011-05-05 US disclosed
US-20110105333-A1 Seed Treatment Compositions and Methods BASF SE (DE) 2011-05-05 US disclosed
US-20110098176-A1 Fungicidal Mixtures Comprising Substituted 1-methylpyrazol-4-ylcarboxanilides BASF SE (DE) 2011-04-28 US disclosed
US-20110071200-A1 3-AMINO-BENZO [D] ISOTHIAZOLE DIOXIDE DERIVATIVES AND THEIR USE AS PESTICIDES SYNGENTA CROP PROTECTION, INC. (US) 2011-03-24 US disclosed
US-20110059973-A1 Pyrazole Compounds for Controlling Invertebrate Pests BASF SE (DE) 2011-03-10 US disclosed
US-20110039904-A1 Alcohol alkoxylates, agents comprising the same and use of the alcohol alkoxylates as adjuvants in the agrochemical field BASF SE (DE) 2011-02-17 US disclosed
US-20110039698-A1 Microemulsion Having Wide Application Range BASF SE (DE) 2011-02-17 US disclosed
US-20110009261-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-01-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (14 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110039904-A1 Alcohol alkoxylates, agents comprising the same and use of the alcohol alkoxylates as adjuvants in the agrochemical field CHRM1, CHRM2, AP2M1 GABRP 1675/4885GABRD 3265/4885GABRA1 1802/4885
US-20110098176-A1 Fungicidal Mixtures Comprising Substituted 1-methylpyrazol-4-ylcarboxanilides CBR3, CYC1, PIK3C3 GABRP 37/4885GABRD 130/4885GABRA1 154/4885
US-20160007609-A1 Pesticidal Mixtures PTMS, THOP1, MLN GABRP 161/4885GABRD 547/4885GABRA1 1673/4885
US-20180007908-A1 Pesticidal Mixtures PTMS, THOP1, MLN GABRP 161/4885GABRD 547/4885GABRA1 1673/4885
US-20110039698-A1 Microemulsion Having Wide Application Range MLYCD, CS, ME1 GABRP 63/4885GABRD 192/4885GABRA1 387/4885
US-20170042156-A1 Pesticidal Active Mixtures Comprising Isoxazoline Compounds I CHRM3, CHRM5, CACNA1C GABRP 255/4885GABRD 363/4885GABRA1 251/4885
US-20110105321-A1 Pesticidal Mixtures Comprising Cyanosulfoximine Compounds CPN1, SRM, STS GABRP 1851/4885GABRD 1678/4885GABRA1 1778/4885
US-20110009261-A1 CHEMICAL COMPOUNDS CBR3, CBR1, CYCS GABRP 3242/4885GABRD 3275/4885GABRA1 2064/4885
US-20110105333-A1 Seed Treatment Compositions and Methods PTK2, BROX, FYN GABRP 1815/4885GABRD 2691/4885GABRA1 1950/4885
US-20110071200-A1 3-AMINO-BENZO [D] ISOTHIAZOLE DIOXIDE DERIVATIVES AND THEIR USE AS PESTICIDES CBR3, CHRM3, BRS3 GABRP 903/4885GABRD 502/4885GABRA1 496/4885
US-20110118212-A1 Pestcidal active mixtures comprising isoxazoline compounds I CHRM3, CHRM5, CHRM1 GABRP 267/4885GABRD 324/4885GABRA1 236/4885
US-20180007904-A1 Pesticidal Active Mixtures Comprising Isoxazoline Compounds I CHRM3, CHRM5, CACNA1C GABRP 255/4885GABRD 363/4885GABRA1 251/4885
US-20110160054-A1 Pesticidal Mixtures Comprising Cyanosulfoximine Compounds and Spinetoram CHRM3, CHRM2, BRS3 GABRP 449/4885GABRD 740/4885GABRA1 468/4885
US-20110059973-A1 Pyrazole Compounds for Controlling Invertebrate Pests GRIN2A, PRXL2A, GRIN3A GABRP 952/4885GABRD 1024/4885GABRA1 809/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.