SCHEMBL9812968

SCHEMBL9812968

O=C(Cl)c1ccc(-c2ccc(C(=O)Cl)cc2Cl)c(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.46
SRD5A2 P31213 2/20 0.42
ALDH1A1 P00352 3/20 0.39
KMO O15229 3/20 0.39
HSD17B1 P14061 1/20 0.39
HSD17B2 P37059 1/20 0.39
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
MAPT P10636 1/20 0.38
PKM P14618 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
TTR P02766 1/20 0.38
ESR1 P03372 2/20 0.38
ESR2 Q92731 2/20 0.38

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
SCHEMBL9812955 0.87 SRD5A2 (0.53) TSHRSRD5A2ALDH1A1HSD17B1HSD17B2
SCHEMBL23484573 0.84 SRD5A2 (0.58) TSHRSRD5A2HSD17B1HSD17B2KDM4E
SCHEMBL6207095 0.84 SRD5A2 (0.50) TSHRSRD5A2ALDH1A1HSD17B1HSD17B2
SCHEMBL29514652 0.83 TSHR (0.67) TSHRSRD5A2KMOKDM4EMEN1
SCHEMBL110094 0.83 TSHR (0.67) TSHRSRD5A2KMOKDM4EMEN1
SCHEMBL2769863 0.81 TSHR (0.71) TSHRSRD5A2ALDH1A1KDM4EMAPT
SCHEMBL6925901 0.80 PTPRC (0.47) TSHRSRD5A2ALDH1A1MEN1NPC1
SCHEMBL5667639 0.80 PTPRC (0.47) TSHRSRD5A2ALDH1A1MEN1NPC1
SCHEMBL4286582 0.79 HSP90AA1 (0.55) TSHRSRD5A2HSD17B1HSD17B2KDM4E
SCHEMBL101687 0.79 TSHR (0.45) TSHRSRD5A2ALDH1A1KMOKDM4E

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-0113252-B1 PROCESS FOR PRODUCING BLOCK COPOLYAMIDE TORAY INDUSTRIES, INC. (JP) 1991-08-07 EP disclosed
US-4507465-A IMPACT STRENGTH TORAY INDUSTRIES, INC. (JP) 1985-03-26 US disclosed
EP-0113252-A2 Process for producing block copolyamide TORAY INDUSTRIES, INC. (JP) 1984-07-11 EP disclosed