SCHEMBL2145803

SCHEMBL2145803

CCCCC(CC)CN1CCCC1=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.54
GAA P10253 2/20 0.43
TSHR P16473 1/20 0.41
CYP2C19 P33261 1/20 0.40
RCE1 Q9Y256 1/20 0.39
CHRM2 P08172 1/20 0.39
HTR1A P08908 1/20 0.39
ADRA2A P08913 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
CHRM1 P11229 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
OPRM1 P35372 1/20 0.39
DRD3 P35462 1/20 0.39
SLC6A3 Q01959 1/20 0.39
KCNH2 Q12809 1/20 0.39
CYP2D6 P10635 1/20 0.39
CA2 P00918 3/20 0.38
LMNA P02545 2/20 0.37
CA12 O43570 1/20 0.37

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
SCHEMBL11856423 0.94 PIK3CD (0.47) PIK3CDGAATSHRCYP2C19RCE1
SCHEMBL19035537 0.87 PIK3CD (0.54) PIK3CDGAATSHRCYP2C19RCE1
SCHEMBL12058905 0.86 PIK3CD (0.66) PIK3CDGAATSHRCYP2C19RCE1
SCHEMBL21217031 0.82 PIK3CD (0.61) PIK3CDGAATSHRCYP2C19RCE1
SCHEMBL23518177 0.79 PIK3CD (0.56) PIK3CDGAATSHRCYP2C19RCE1
SCHEMBL6561449 0.78 SMN1; SMN2 (0.40) TSHRCHRM2HTR1AADRA2AADORA3
SCHEMBL22548332 0.76 PIK3CD (0.45) PIK3CDGAATSHRLMNA
SCHEMBL26934761 0.76 CHRM2 (0.42) TSHRCHRM2HTR1AADRA2AADORA3
SCHEMBL9018974 0.75 PIK3CD (0.51) PIK3CDGAATSHRCYP2C19RCE1
SCHEMBL7042848 0.75 PIK3CD (0.47) PIK3CDTSHRCHRM2CHRM1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10785973-B2 Aqueous pesticide microemulsion BASF SE (DE) 2020-09-29 US claimed
EP-3188597-B1 AQUEOUS PESTICIDE MICROEMULSION BASF SE (DE) 2019-02-06 EP claimed
US-20170280710-A1 AQUEOUS PESTICIDE MICROEMULSION BASF SE (DE) 2017-10-05 US claimed
EP-3188597-A1 AQUEOUS PESTICIDE MICROEMULSION BASF SE (DE) 2017-07-12 EP claimed
CN-106793772-A Aqueous pesticide microemulsion 巴斯夫欧洲公司 2017-05-31 CN claimed
US-9461228-B2 Thermoelectric conversion material and method for manufacturing same LINTEC CORPORATION (JP) 2016-10-04 US claimed
WO-2016034618-A1 AQUEOUS PESTICIDE MICROEMULSION BASF SE (DE) 2016-03-10 WO claimed
US-20130065759-A1 PREFORMED CONCENTRATE FOR DELIVERY OF WATER INSOLUBLE FILM FORMING POLYMERS ISP INVESTMENTS INC. (US) 2013-03-14 US claimed
EP-2545088-A1 A PREFORMED CONCENTRATE FOR DELIVERY OF WATER INSOLUBLE FILM FORMING POLYMERS Isp Investments Inc. (US) 2013-01-16 EP claimed
CN-102834423-A A preformed concentrate for delivery of water insoluble film forming polymers ISP INVESTMENTS INC 2012-12-19 CN claimed
US-5354726-A Hydrophilic and hydrophobic solvents prevent precipitation on extended storage ISP INVESTMENTS INC. (US) 1994-10-11 US claimed
US-5283229-A A concentrate emulsions comprising an active materials, a surfactant and an amide solvent mixtures to dissolve, dispersing the water insoluble active materials; stability ISP INVESTMENTS INC. (US) 1994-02-01 US claimed
US-5250499-A Delivery system for agricultural chemicals ISP INVESTMENTS INC. (US) 1993-10-05 US claimed
EP-0505378-A4 DELIVERY SYSTEM FOR AGRICULTURAL CHEMICALS 1993-03-10 EP claimed
WO-1993000809-A1 DELIVERY SYSTEM FOR AGRICULTURAL CHEMICALS ISP INVESTMENTS INC. (US) 1993-01-21 WO claimed
US-5176736-A Emulsifiable herbicide concentrate ISP INVESTMENTS INC. (US) 1993-01-05 US claimed
US-5156666-A Emulsifiable concentrate comprising a pesticide, a surfactant, a hydrophobic solvent and a hydrophilic solvent; storage stability ISP INVESTMENTS INC. (US) 1992-10-20 US claimed
EP-0505378-A1 DELIVERY SYSTEM FOR AGRICULTURAL CHEMICALS ISP INVESTMENTS INC. (US) 1992-09-30 EP claimed
US-5071463-A Stable, emulsifiable concentrate of an herbicide and pyrrolido ne derivative; dispersibility ISP INVESTMENTS INC. (US) 1991-12-10 US claimed
WO-1991008665-A1 DELIVERY SYSTEM FOR AGRICULTURAL CHEMICALS ISP INVESTMENTS INC. (US) 1991-06-27 WO claimed

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

For each of this compound's patents that has machine-readable text (3 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-20170280710-A1 AQUEOUS PESTICIDE MICROEMULSION PLD1, CHRM2, PLD2 PIK3CD 1911/4885GAA 2880/4885TSHR 2253/4885
US-20130065759-A1 PREFORMED CONCENTRATE FOR DELIVERY OF WATER INSOLUBLE FILM FORMING POLYMERS PRR12, PLTP, PHOSPHO1 PIK3CD 2893/4885GAA 1368/4885TSHR 4505/4885
US-10785973-B2 Aqueous pesticide microemulsion PLD1, CHRM2, PLD2 PIK3CD 1911/4885GAA 2880/4885TSHR 2253/4885

“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.