SCHEMBL12924273

SCHEMBL12924273

Cc1ccc(-c2cc3c(s2)-c2ccc4c5c(ccc-3c25)-c2sc(-c3ccc(-c5ccccc5)cc3)cc2-4)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTP4A3 O75365 2/20 0.44
▸ HSD17B1 P14061 3/20 0.42
▸ PTP4A2 Q12974 1/20 0.39
▸ PTP4A1 Q93096 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ ESR1 P03372 5/20 0.38
▸ HPRT1 P00492 1/20 0.38
▸ ALOX5 P09917 1/20 0.38
▸ HSD17B2 P37059 2/20 0.37
▸ ESR2 Q92731 3/20 0.37
▸ NPC1 O15118 1/20 0.36
▸ CASP3 P42574 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ SENP8 Q96LD8 1/20 0.36
▸ SENP7 Q9BQF6 1/20 0.36
▸ SENP6 Q9GZR1 1/20 0.36
▸ AGTR1 P30556 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35

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
SCHEMBL12924298 0.92 ESR1 (0.42) PTP4A3HSD17B1PTP4A2PTP4A1ESR1
SCHEMBL12924310 0.92 HSD17B1 (0.47) PTP4A3HSD17B1PTP4A2PTP4A1MEN1
SCHEMBL12924307 0.92 ESR1 (0.42) PTP4A3HSD17B1PTP4A2PTP4A1ESR1
SCHEMBL12924306 0.88 HSD17B1 (0.50) PTP4A3HSD17B1PTP4A2PTP4A1MEN1
SCHEMBL12924272 0.88 HSD17B1 (0.50) PTP4A3HSD17B1PTP4A2PTP4A1MEN1
SCHEMBL12924238 0.85 HSD17B1 (0.47) PTP4A3HSD17B1PTP4A2PTP4A1MEN1
SCHEMBL14707331 0.82 PTP4A3 (0.32) PTP4A3HSD17B1ESR1
SCHEMBL11521678 0.80 HSD17B1 (0.58) PTP4A3HSD17B1PTP4A2PTP4A1MEN1
SCHEMBL11521308 0.80 HSD17B1 (0.58) PTP4A3HSD17B1PTP4A2PTP4A1MEN1
SCHEMBL16546086 0.79 PTP4A3 (0.42) PTP4A3PTP4A2PTP4A1ESR1ESR2

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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