SCHEMBL10145012

SCHEMBL10145012

CC(C)(C)c1ccc(SC(F)(F)F)cc1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.62
EPHX2 P34913 1/20 0.57
NR1H4 Q96RI1 1/20 0.57
LMNA P02545 3/20 0.54
ALDH1A1 P00352 3/20 0.54
HTT P42858 2/20 0.54
KDM4E B2RXH2 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
POLB P06746 1/20 0.54
GAA P10253 1/20 0.54
PTPRZ1 P23471 4/20 0.47
PTPN1 P18031 2/20 0.47
TSHR P16473 1/20 0.44
TYR P14679 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.38
KIF11 P52732 2/20 0.38
KCNK2 O95069 1/20 0.37
KCNK10 P57789 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
SCHEMBL11333974 0.80 TSHR (0.48) TRPV1EPHX2NR1H4LMNAALDH1A1
SCHEMBL7014603 0.80 ALDH1A1 (0.58) TRPV1EPHX2NR1H4LMNAALDH1A1
SCHEMBL25118324 0.79 TRPV1 (0.44) TRPV1EPHX2NR1H4LMNAALDH1A1
SCHEMBL12807846 0.77 TRPV1 (0.43) TRPV1EPHX2NR1H4LMNAALDH1A1
SCHEMBL31018988 0.76 ALDH1A1 (0.48) TRPV1EPHX2NR1H4LMNAALDH1A1
SCHEMBL765788 0.75 TDP1 (0.58) TRPV1EPHX2NR1H4LMNAALDH1A1
SCHEMBL15146228 0.75 TSHR (0.48) TRPV1EPHX2NR1H4LMNAALDH1A1
SCHEMBL11066182 0.75 ALDH1A1 (0.58) TRPV1EPHX2NR1H4LMNAALDH1A1
SCHEMBL16802090 0.75 LMNA (0.52) TRPV1EPHX2NR1H4LMNAALDH1A1
SCHEMBL24499138 0.74 TRPV1 (0.46) TRPV1LMNAALDH1A1TSHRTYR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230278958-A1 TRICYCLIC HETEROCYCLES MERCK PATENT GMBH (DE) 2023-09-07 US disclosed
US-20230278958-A1 TRICYCLIC HETEROCYCLES MERCK PATENT GMBH (DE) 2023-09-07 US disclosed
CN-114478332-B Synthesis method of alkyl trifluoromethyl sulfide 江南大学 2023-07-04 CN disclosed
US-20230174538-A1 Tricyclic heterocycles MERCK PATENT GMBH (DE) 2023-06-08 US disclosed
US-20230174538-A1 Tricyclic heterocycles MERCK PATENT GMBH (DE) 2023-06-08 US disclosed
CN-114478332-A Synthesis method of alkyl trifluoromethyl sulfide 江南大学 2022-05-13 CN disclosed
CN-112375022-B Preparation method of trifluoromethyl aryl sulfide 江南大学 2022-01-11 CN disclosed
US-11214541-B2 Substituted 6,7-dihydro-5H-benzo[7]annulene compounds, processes for their preparation and therapeutic uses thereof SANOFI (FR) 2022-01-04 US disclosed
US-20210323916-A1 NOVEL SUBSTITUTED 6,7-DIHYDRO-5H-BENZO[7]ANNULENE COMPOUNDS, PROCESSES FOR THEIR PREPARATION AND THERAPEUTIC USES THEREOF SANOFI (FR) 2021-10-21 US disclosed
CN-112375022-A Preparation method of trifluoromethyl aryl sulfide 江南大学 2021-02-19 CN disclosed
US-20110319393-A1 ANTHELMINTIC AGENTS AND THEIR USE INTERVET INTERNATIONAL B.V. (NL) 2011-12-29 US disclosed
US-20100317653-A1 OXADIAZOLE DERIVATIVES AS DGAT INHIBITORS ASTRAZENECA AB (SE) 2010-12-16 US disclosed
US-7795283-B2 Oxadiazole derivative as DGAT inhibitors ASTRAZENECA AB (SE) 2010-09-14 US disclosed
US-7667036-B2 MAPKAP-K2 (mitogen-activated protein kinase-activated protein kinase 2) inhibitors; inflammatory, autoimmune disease, destructive bone disorder, cancer and/or tumor growth; angiogenesis, diabetes and neurological disorders TEIJIN PHARMA LIMITED (JP) 2010-02-23 US disclosed
US-7557110-B2 MAPKAP-K2; inflammatory disease, autoimmune disease, destructive bone disorder, cancer and/or tumour growth; 5-[(trans-4-aminocyclohexyl)amino]-3-fluoro-6-methyl(pyrazolo[1,5-a]pyri- midin-7-yl)}(4-iodophenyl)amine TEIJIN PHARMA LIMITED (JP) 2009-07-07 US disclosed
US-20080312435-A1 Imine Compound TAISHO PHARMACEUTICAL CO., LTD. (JP) 2008-12-18 US disclosed
US-7402674-B2 7-Phenylamino-4-quinolone-3-carboxylic acid derivatives, process for their preparation and their use as medicaments SANOFI-AVENTIS DEUTSCHLAND GMBH, (DE) 2008-07-22 US disclosed
US-20080097078-A1 Antibacterial activity against vancomycin-resistant bacteria SHIONOGI & CO., LTD. (JP) 2008-04-24 US disclosed
US-20080097078-A1 Antibacterial activity against vancomycin-resistant bacteria SHIONOGI & CO., LTD. (JP) 2008-04-24 US disclosed
US-20080096874-A1 Oxadiazole Derivative as Dgat Inhibitors ASTRAZENECA AB (SE) 2008-04-24 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 (9 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-20110319393-A1 ANTHELMINTIC AGENTS AND THEIR USE ACHE, ABCB11, MPO TRPV1 185/4885EPHX2 239/4885NR1H4 1493/4885
US-20100317653-A1 OXADIAZOLE DERIVATIVES AS DGAT INHIBITORS DGAT1, DGAT2, GPR119 TRPV1 4222/4885EPHX2 2036/4885NR1H4 177/4885
US-20080312435-A1 Imine Compound CNR1, CNR2, HRH4 TRPV1 8/4885EPHX2 2562/4885NR1H4 364/4885
US-20230278958-A1 TRICYCLIC HETEROCYCLES YAP1, TERF2IP, TEAD1 TRPV1 4215/4885EPHX2 4109/4885NR1H4 1743/4885
US-11214541-B2 Substituted 6,7-dihydro-5H-benzo[7]annulene compounds, processes for their preparation and therapeutic uses thereof CYP19A1, ESR1, GPER1 TRPV1 2635/4885EPHX2 1421/4885NR1H4 130/4885
US-20210323916-A1 NOVEL SUBSTITUTED 6,7-DIHYDRO-5H-BENZO[7]ANNULENE COMPOUNDS, PROCESSES FOR THEIR PREPARATION AND THERAPEUTIC USES THEREOF CYP19A1, ESR1, ESR2 TRPV1 2554/4885EPHX2 1215/4885NR1H4 101/4885
US-20080096874-A1 Oxadiazole Derivative as Dgat Inhibitors DGAT1, DGAT2, GPR119 TRPV1 4229/4885EPHX2 2517/4885NR1H4 202/4885
US-20230174538-A1 Tricyclic heterocycles YAP1, TEAD1, TERF2IP TRPV1 3731/4885EPHX2 3994/4885NR1H4 1442/4885
US-20080097078-A1 Antibacterial activity against vancomycin-resistant bacteria CSGALNACT1, MON2, NR2C2 TRPV1 1892/4885EPHX2 3420/4885NR1H4 33/4885

“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.