SCHEMBL17973779

SCHEMBL17973779

CCC(C)(C)c1ccc(-c2ccc(N(c3ccc(-c4ccc5c(c4)CC5)cc3)c3ccc(-c4ccc5c(c4)CC5)cc3)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 3/20 0.35
▸ RAB9A P51151 3/20 0.35
▸ MAPT P10636 1/20 0.35
▸ CNR2 P34972 3/20 0.34
▸ LMNA P02545 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ CASP3 P42574 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ SENP8 Q96LD8 1/20 0.33
▸ SENP7 Q9BQF6 1/20 0.33
▸ SENP6 Q9GZR1 1/20 0.33
▸ HRH3 Q9Y5N1 7/20 0.32
▸ MAOB P27338 6/20 0.32
▸ ADORA1 P30542 1/20 0.31
▸ HSD17B3 P37058 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ KIF11 P52732 1/20 0.31
▸ PTPN1 P18031 1/20 0.30

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
SCHEMBL17973777 0.94 HSD17B3 (0.39) NPC1RAB9AMAPTCNR2LMNA
SCHEMBL17973783 0.94 NPC1 (0.35) NPC1RAB9AMAPTCNR2LMNA
SCHEMBL19798782 0.89 NPC1 (0.38) NPC1RAB9AMAPTCNR2LMNA
SCHEMBL17973766 0.89 NPC1 (0.38) NPC1RAB9AMAPTCNR2LMNA
SCHEMBL17973778 0.88 NPC1 (0.36) NPC1RAB9AMAPTCNR2LMNA
SCHEMBL17973770 0.83 NPC1 (0.34) NPC1RAB9AMAPTCNR2LMNA
SCHEMBL21573976 0.83 NPC1 (0.34) NPC1RAB9AMAPTCNR2LMNA
SCHEMBL17973768 0.83 NPC1 (0.39) NPC1RAB9AMAPTCNR2LMNA
SCHEMBL17987020 0.79 ADCY8 (0.41) NPC1RAB9AMAPTMAPK1HRH3
SCHEMBL17973784 0.79 NPC1 (0.35) NPC1RAB9AMAPTLMNAMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160225998-A1 CHARGE-TRANSPORTING MATERIAL AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-08-04 — — US disclosed
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