SCHEMBL13410140

SCHEMBL13410140

CCCCCCc1ccsc1-c1ccc(-c2ccc(-c3sc(-c4ccc(CCc5ccc(-c6cc(CCCCCC)c(-c7ccc(-c8ccc(-c9sccc9CCCCCC)s8)s7)s6)cc5)cc4)cc3CCCCCC)s2)s1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ HSD17B10 Q99714 3/20 0.34
▸ TSHR P16473 1/20 0.34
▸ RARB P10826 8/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ RARA P10276 2/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ MTOR P42345 1/20 0.33
▸ ESR1 P03372 2/20 0.33
▸ ADRA2A P08913 2/20 0.33
▸ ADORA3 P0DMS8 2/20 0.33
▸ TACR2 P21452 2/20 0.33
▸ SLC6A2 P23975 2/20 0.33
▸ SLC6A4 P31645 2/20 0.33
▸ SLC6A3 Q01959 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ SHBG P04278 1/20 0.33

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
SCHEMBL10819418 0.95 MEN1 (0.33) TSHRMEN1MAPTKMT2ATP53
SCHEMBL13410117 0.95 MEN1 (0.33) TSHRMEN1MAPTKMT2ATP53
SCHEMBL13410196 0.94 KDM4E (0.32) KDM4ERAB9AHSD17B10TSHRRARB
SCHEMBL12885218 0.90 MEN1 (0.33) TSHRMEN1MAPTKMT2ATP53
SCHEMBL12893319 0.89 LTB4R (0.37) KDM4ERAB9AALDH1A1MAPTKMT2A
SCHEMBL10819415 0.89 TYR (0.35) TSHRMEN1MAPTKMT2ATP53
SCHEMBL10164725 0.89 TYR (0.35) TSHRMEN1MAPTKMT2ATP53
SCHEMBL18090329 0.89 TYR (0.35) TSHRMEN1MAPTKMT2ATP53
SCHEMBL85811 0.89 TYR (0.35) TSHRMEN1MAPTKMT2ATP53
SCHEMBL85810 0.89 TYR (0.35) TSHRMEN1MAPTKMT2ATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8441002-B2 Organic semiconductor composite, organic transistor material and organic field effect transistor TORAY INDUSTRIES, INC. (JP) 2013-05-14 — — US disclosed
US-20100102299-A1 ORGANIC SEMICONDUCTOR COMPOSITE, ORGANIC TRANSISTOR MATERIAL AND ORGANIC FIELD EFFECT TRANSISTOR TORAY INDUSTRIES, INC. (JP) 2010-04-29 — — US disclosed
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