SCHEMBL12924308

SCHEMBL12924308

Fc1cccc(-c2cc3c(s2)-c2ccc4c5c(ccc-3c25)-c2sc(-c3cccc(F)c3)cc2-4)c1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HSD17B1 P14061 5/20 0.46
▸ HSD17B2 P37059 4/20 0.46
▸ ESR1 P03372 3/20 0.40
▸ KDM4E B2RXH2 2/20 0.38
▸ TAAR1 Q96RJ0 2/20 0.37
▸ ESR2 Q92731 2/20 0.37
▸ PTP4A3 O75365 2/20 0.36
▸ PDK2 Q15119 1/20 0.36
▸ ESRRG P62508 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ PTP4A2 Q12974 1/20 0.35
▸ PTP4A1 Q93096 1/20 0.35
▸ STK17B O94768 1/20 0.34

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
SCHEMBL12924336 0.88 HDAC6 (0.44) HSD17B1HSD17B2KDM4E
SCHEMBL12924253 0.84 ESR1 (0.42) HSD17B1HSD17B2ESR1ESR2MEN1
SCHEMBL12924324 0.84 ESR1 (0.42) HSD17B1HSD17B2ESR1ESR2MEN1
SCHEMBL12924306 0.84 HSD17B1 (0.50) HSD17B1HSD17B2ESR1KDM4EESR2
SCHEMBL12924272 0.84 HSD17B1 (0.50) HSD17B1HSD17B2ESR1KDM4EESR2
SCHEMBL12924310 0.81 HSD17B1 (0.47) HSD17B1HSD17B2ESR1ESR2PTP4A3
SCHEMBL12924238 0.81 HSD17B1 (0.47) HSD17B1HSD17B2ESR1KDM4EESR2
SCHEMBL14707330 0.81 HSD17B1 (0.33) HSD17B1HSD17B2
SCHEMBL12924255 0.80 ESR1 (0.43) HSD17B1HSD17B2ESR1ESR2PTP4A3
SCHEMBL13556975 0.76 HTR2C (0.36) HSD17B1HSD17B2ESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8294144-B2 Organic transistor YAMAMOTO CHEMICALS, INC. (JP) 2012-10-23 — — US disclosed
US-8294144-B2 Organic transistor YAMAMOTO CHEMICALS, INC. (JP) 2012-10-23 — — US disclosed
US-20110012098-A1 ORGANIC TRANSISTOR YAMAMOTO CHEMICALS, INC. (JP) 2011-01-20 — — US disclosed
US-20110012098-A1 ORGANIC TRANSISTOR YAMAMOTO CHEMICALS, INC. (JP) 2011-01-20 — — US disclosed
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