SCHEMBL3199583

SCHEMBL3199583

FC(F)(F)c1ccccc1-c1cccc(Cl)c1C(F)(F)F

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 7/20 0.49
TRPA1 O75762 1/20 0.44
TRPM8 Q7Z2W7 1/20 0.44
TRPV1 Q8NER1 1/20 0.44
AR P10275 1/20 0.41
P2RX7 Q99572 1/20 0.39
NOTUM Q6P988 3/20 0.39
PDK2 Q15119 3/20 0.39
ALDH1A1 P00352 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
ALOX15 P16050 1/20 0.37
MAPK1 P28482 1/20 0.37
CYP2C19 P33261 1/20 0.37
HSD17B10 Q99714 1/20 0.37
STK10 O94804 1/20 0.37
SLK Q9H2G2 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
SCHEMBL1262778 0.84 HSD11B1 (0.59) HSD11B1TRPA1TRPM8TRPV1AR
SCHEMBL29010101 0.81 HSD11B1 (0.43) HSD11B1TRPA1TRPM8TRPV1P2RX7
SCHEMBL1041749 0.81 NOTUM (0.43) HSD11B1ARP2RX7NOTUMALDH1A1
SCHEMBL3992465 0.79 HSD11B1 (0.47) HSD11B1TRPA1TRPM8TRPV1AR
SCHEMBL27907878 0.78 CYP2A6 (0.56) HSD11B1ARNOTUMPDK2ALDH1A1
SCHEMBL197671 0.78 HSD11B1 (0.56) HSD11B1TRPA1TRPM8TRPV1AR
SCHEMBL23044990 0.78 HSD11B1 (0.43) HSD11B1TRPA1TRPM8TRPV1AR
SCHEMBL11967616 0.77 HSD11B1 (0.49) HSD11B1TRPA1ARNOTUMPDK2
SCHEMBL6067687 0.77 HSD11B1 (0.55) HSD11B1ARP2RX7NOTUMPDK2
SCHEMBL8722602 0.76 NOTUM (0.50) NOTUMPDK2ALDH1A1CYP2C19

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1955990-B1 PROCESS FOR PRODUCTION OF BIPHENYL DERIVATIVES TORAY FINECHEMICALS CO LTD (JP) 2012-08-22 EP disclosed
US-20100036167-A1 PROCESS FOR PRODUCTION OF 2,2'-BIS(TRIFLUOROMETHYL)-4,4'-DIAMINOBIPHENYL TORAY FINE CHEMICALS CO., LTD. (JP) 2010-02-11 US disclosed
EP-2100874-A1 PROCESS FOR PRODUCTION OF 2,2'-BIS(TRIFLUOROMETHYL)- 4,4'-DIAMINOBIPHENYL Toray Fine Chemicals Co., Ltd. (JP) 2009-09-16 EP 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 (1 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-20100036167-A1 PROCESS FOR PRODUCTION OF 2,2'-BIS(TRIFLUOROMETHYL)-4,4'-DIAMINOBIPHENYL DDT, DBF4, CYP4B1 HSD11B1 2225/4885TRPA1 1315/4885TRPM8 3714/4885

“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.