SCHEMBL4387585

SCHEMBL4387585

CC(C)(C)CC(C)(C)c1cccc(C(C)(C)c2ccccc2-n2nc3ccccc3n2)c1O

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.34
CA2 P00918 1/20 0.33
ATM Q13315 1/20 0.33
KDM4E B2RXH2 1/20 0.31
SHBG P04278 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
SCHEMBL2944734 0.89 NPC1 (0.40) NPC1RAB9ALMNAPOLBCA2
SCHEMBL30389113 0.89 NPC1 (0.40) NPC1RAB9ALMNAPOLBCA2
SCHEMBL28894056 0.85 NPC1 (0.38) NPC1RAB9ALMNAPOLBKDM4E
SCHEMBL8400879 0.82 HTT (0.38) NPC1RAB9ALMNACA2ATM
SCHEMBL4398146 0.81 KDM4E (0.36) NPC1RAB9ALMNAPOLBCA2
SCHEMBL7141288 0.77 POLB (0.47) NPC1RAB9ALMNAPOLBATM
SCHEMBL2231426 0.77 NPC1 (0.41) NPC1RAB9ALMNAPOLBCA2
SCHEMBL6035514 0.76 NPC1 (0.36) NPC1RAB9ALMNAPOLBATM
SCHEMBL3320509 0.76 RAB9A (0.43) NPC1RAB9ALMNAPOLBKDM4E
SCHEMBL3320508 0.76 RAB9A (0.37) NPC1RAB9ALMNACA2ATM

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-20090298978-A1 Stabilized organic materials containing fillers CIBA SPECIALTY CHEMICALS CORP. 2009-12-03 US disclosed
US-5965641-A A STERICALLY HINDERED PIPERIDINE COMPOUND, OR AN OLIGOMERIC OR POLYMERIC STERICALLY HINDERED PIPERIDINE COMPOUND CONTAINING ONE OR SEVERAL TRIAZINE UNITS; RADIATION RESISTANCE, OXIDATION RESISTANCE CIBA SPECIALTY CHEMICALS CORPORATION (US) 1999-10-12 US disclosed