SCHEMBL11540965

SCHEMBL11540965

CCCCNC(=O)Oc1ccc(C(C)(C)CC(C)(C)C)cc1-n1nc2ccccc2n1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.43
ALDH1A1 P00352 4/20 0.43
RAB9A P51151 4/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
NCEH1 Q6PIU2 1/20 0.42
KDM4E B2RXH2 3/20 0.40
MAPT P10636 3/20 0.40
HPGD P15428 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
POLB P06746 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MGLL Q99685 2/20 0.37

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
SCHEMBL11540968 0.90 NPC1 (0.43) NPC1ALDH1A1RAB9ASMN1; SMN2NCEH1
SCHEMBL11541708 0.90 NPC1 (0.46) NPC1ALDH1A1RAB9ASMN1; SMN2KDM4E
SCHEMBL11541710 0.83 NPC1 (0.43) NPC1ALDH1A1RAB9ASMN1; SMN2KDM4E
SCHEMBL11542384 0.83 NPC1 (0.45) NPC1ALDH1A1RAB9ASMN1; SMN2KDM4E
SCHEMBL11541788 0.83 NPC1 (0.63) NPC1ALDH1A1RAB9ASMN1; SMN2NCEH1
SCHEMBL4253904 0.80 NPC1 (0.50) NPC1ALDH1A1RAB9ASMN1; SMN2KDM4E
SCHEMBL11542390 0.78 ALDH1A1 (0.42) NPC1ALDH1A1RAB9ASMN1; SMN2KDM4E
SCHEMBL11541586 0.77 ALDH1A1 (0.37) ALDH1A1NCEH1
SCHEMBL7186173 0.77 KDM4E (0.40) NPC1ALDH1A1RAB9ASMN1; SMN2KDM4E
Benzene SCHEMBL9190034 0.75 NPC1 (0.41) NPC1ALDH1A1RAB9ASMN1; SMN2KDM4E

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-4179548-A UV curable resin compositions containing urethanes of hydroxybenzotriazoles or urethanes of hydroxy benzophenones GENERAL ELECTRIC COMPANY (US) 1979-12-18 US disclosed
US-4061652-A Urethanes of hydroxybenzotriazoles GENERAL ELECTRIC COMPANY (US) 1977-12-06 US disclosed