SCHEMBL13553389

SCHEMBL13553389

CCC(C)(C)c1ccc(-c2ccc(-c3ccc(C(C)(C)C)cc3)c3nsnc23)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 3/20 0.37
▸ NPC1 O15118 5/20 0.37
▸ RAB9A P51151 5/20 0.37
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ LMNA P02545 2/20 0.36
▸ TP53 P04637 2/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ CASP3 P42574 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ SENP8 Q96LD8 1/20 0.36
▸ SENP7 Q9BQF6 1/20 0.36
▸ SENP6 Q9GZR1 1/20 0.36
▸ DGAT1 O75907 2/20 0.36
▸ MAPT P10636 1/20 0.35
▸ KDM4E B2RXH2 2/20 0.34
▸ ALDH1A1 P00352 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ TNF P01375 1/20 0.32

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
SCHEMBL14435170 0.95 NPC1 (0.39) NPC1RAB9ASMN1; SMN2LMNAMAPK1
SCHEMBL18040333 0.88 KIF11 (0.45) KIF11NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL14463577 0.88 KIF11 (0.37) KIF11NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL13892802 0.85 NPC1 (0.36) NPC1RAB9ASMN1; SMN2LMNAMAPK1
SCHEMBL14495809 0.84 CNR2 (0.32) KIF11NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL25475487 0.81 KIF11 (0.39) KIF11NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL27697517 0.79 KIF11 (0.38) KIF11NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL14493024 0.79 CNR2 (0.33) NPC1RAB9ASMN1; SMN2LMNAMAPK1
SCHEMBL19480532 0.77 KIF11 (0.52) KIF11NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL3625528 0.75 NPC1 (0.52) KIF11NPC1RAB9ASMN1; SMN2LMNA

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
WO-2010010337-A1 COMPOSITIONS AND METHODS FOR MANUFACTURING LIGHT-EMISSIVE DEVICES CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2010-01-28 — — WO disclosed
WO-2009066061-A1 LIGHT-EMITTING DEVICE AND MATERIALS THEREFOR CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2009-05-28 — — WO disclosed
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