SCHEMBL9510127

SCHEMBL9510127

CCCCCc1ccc(-c2ccc(C#Cc3ccc(OC)c(F)c3F)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.48
HSD17B10 Q99714 1/20 0.48
FFAR1 O14842 1/20 0.40
RARB P10826 7/20 0.39
RARA P10276 2/20 0.39
RARG P13631 1/20 0.39
MAPT P10636 2/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MTOR P42345 1/20 0.38
KMT2A Q03164 1/20 0.38
PPARG P37231 1/20 0.37
PPARA Q07869 1/20 0.37
RAB9A P51151 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CASP3 P42574 1/20 0.37
SENP8 Q96LD8 1/20 0.37
SENP7 Q9BQF6 1/20 0.37
SENP6 Q9GZR1 1/20 0.37
HRH3 Q9Y5N1 1/20 0.36

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
SCHEMBL9508748 0.99 HSD17B10 (0.50) TSHRHSD17B10FFAR1RARBRARA
SCHEMBL9510181 0.99 HSD17B10 (0.50) TSHRHSD17B10FFAR1RARBRARA
SCHEMBL9510153 0.97 HSD17B10 (0.43) TSHRHSD17B10FFAR1RARBRARA
SCHEMBL9512554 0.96 HSD17B10 (0.46) TSHRHSD17B10FFAR1RARBRARA
SCHEMBL9508776 0.96 HSD17B10 (0.46) TSHRHSD17B10FFAR1RARBRARA
SCHEMBL9510224 0.96 TSHR (0.43) TSHRHSD17B10FFAR1RARBRARA
SCHEMBL9509124 0.94 FFAR1 (0.42) TSHRHSD17B10FFAR1
SCHEMBL9511390 0.91 FFAR1 (0.42) TSHRHSD17B10FFAR1
SCHEMBL9509905 0.90 HSD17B10 (0.48) TSHRHSD17B10RARBRARARARG
SCHEMBL9512408 0.89 HSD17B10 (0.47) TSHRHSD17B10RARBRARARARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0308438-B1 LIQUID CRYSTAL PHASE CONTAINING TOLANES MERCK PATENT GmbH (DE) 1993-09-29 EP disclosed