SCHEMBL7609481

SCHEMBL7609481

CC(C)(C)c1ccc2oc(-c3ccc(C=Cc4ccccc4)cc3)nc2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.59
RAB9A P51151 7/20 0.59
GFER P55789 2/20 0.59
HDAC6 Q9UBN7 4/20 0.54
HDAC3 O15379 2/20 0.54
HDAC1 Q13547 2/20 0.54
HDAC2 Q92769 2/20 0.54
HDAC8 Q9BY41 2/20 0.54
SMN1; SMN2 Q16637 7/20 0.51
KDM4E B2RXH2 5/20 0.51
HPGD P15428 3/20 0.51
CASP3 P42574 2/20 0.51
SENP7 Q9BQF6 2/20 0.51
SENP6 Q9GZR1 2/20 0.51
POLB P06746 2/20 0.51
SENP8 Q96LD8 1/20 0.51
TP53 P04637 4/20 0.47
ALDH1A1 P00352 4/20 0.47
HSD17B10 Q99714 2/20 0.47
MAPT P10636 3/20 0.45

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
SCHEMBL14365418 1.00 NPC1 (0.59) NPC1RAB9AGFERHDAC6HDAC3
SCHEMBL29881441 0.96 NPC1 (0.57) NPC1RAB9AGFERHDAC6HDAC3
SCHEMBL11134813 0.96 NPC1 (0.57) NPC1RAB9AGFERHDAC6HDAC3
SCHEMBL8345323 0.96 NPC1 (0.57) NPC1RAB9AGFERHDAC6HDAC3
SCHEMBL7887300 0.95 NPC1 (0.64) NPC1RAB9AGFERHDAC6HDAC3
SCHEMBL7887297 0.95 NPC1 (0.64) NPC1RAB9AGFERHDAC6HDAC3
SCHEMBL7607309 0.94 NPC1 (0.57) NPC1RAB9AGFERHDAC6HDAC3
SCHEMBL7607314 0.94 NPC1 (0.57) NPC1RAB9AGFERHDAC6HDAC3
SCHEMBL28820768 0.89 NPC1 (0.57) NPC1RAB9AGFERHDAC6HDAC3
SCHEMBL29882542 0.89 NPC1 (0.57) NPC1RAB9AGFERHDAC6HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7306809-B2 Optically activated particles for use in cosmetic compositions LIPO CHEMICALS, INC. (US) 2007-12-11 US disclosed
US-7306809-B2 Optically activated particles for use in cosmetic compositions LIPO CHEMICALS, INC. (US) 2007-12-11 US disclosed
CN-1167690-C Preparation of mixtures of benzoxazole-stilbene compounds 伊斯曼化学公司 2004-09-22 CN disclosed
CN-1407976-A Preparation of mixtures of benzoxazolyl-stilbene compounds EASTMAN CHEM CO (US) 2003-04-02 CN disclosed
EP-1265876-A1 PREPARATION OF MIXTURES OF BENZOXAZOLYL-STILBENE COMPOUNDS EASTMAN CHEMICAL COMPANY (US) 2002-12-18 EP disclosed
WO-2001064658-A1 PREPARATION OF MIXTURES OF BENZOXAZOLYL-STILBENE COMPOUNDS EASTMAN CHEMICAL COMPANY (US) 2001-09-07 WO disclosed