SCHEMBL17483597

SCHEMBL17483597

CCc1ccc2c(c1)sc1c2sc2c3ccc(C)cc3sc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.39
NPC1 O15118 4/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MAPT P10636 6/20 0.38
LMNA P02545 4/20 0.38
GAA P10253 1/20 0.38
KIF11 P52732 1/20 0.38
BCL2L1 Q07817 1/20 0.37
MCL1 Q07820 1/20 0.37
KDM4E B2RXH2 1/20 0.36
PARP15 Q460N3 1/20 0.35
PARP10 Q53GL7 1/20 0.35
TNKS2 Q9H2K2 1/20 0.35
PARP2 Q9UGN5 1/20 0.35
PIM1 P11309 1/20 0.33
PIM2 Q9P1W9 1/20 0.33
TRPA1 O75762 1/20 0.33
THRB P10828 2/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 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
SCHEMBL1687688 0.93 NPC1 (0.43) RAB9ANPC1SMN1; SMN2MAPTLMNA
SCHEMBL10031393 0.89 NPC1 (0.46) RAB9ANPC1SMN1; SMN2MAPTLMNA
SCHEMBL11892121 0.87 BCL2L1 (0.44) RAB9ANPC1SMN1; SMN2MAPTLMNA
SCHEMBL12796843 0.87 BCL2L1 (0.44) RAB9ANPC1SMN1; SMN2MAPTLMNA
SCHEMBL17483598 0.87 MAPT (0.40) RAB9ANPC1SMN1; SMN2MAPTLMNA
SCHEMBL17483599 0.84 NPC1 (0.42) RAB9ANPC1SMN1; SMN2MAPTLMNA
SCHEMBL3123994 0.83 BCL2L1 (0.47) RAB9ANPC1SMN1; SMN2MAPTLMNA
SCHEMBL17483600 0.83 TP53 (0.38) RAB9ANPC1SMN1; SMN2LMNAKDM4E
SCHEMBL10084781 0.82 ESR1 (0.39) LMNAKDM4EALDH1A1
SCHEMBL16070302 0.82 ESR1 (0.39) LMNAKDM4EALDH1A1

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-9905783-B2 Solution for a semiconducting layer of an organic electronic device CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2018-02-27 US disclosed
US-20160035987-A1 ORGANIC SEMICONDUCTING BLEND CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2016-02-04 US disclosed