SCHEMBL9302498

SCHEMBL9302498

CC(C)(C)CC(C)(C)c1cc(-n2nc3ccc(Sc4ccccc4)cc3n2)c(O)c(C(C)(C)CC(C)(C)C)c1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
EGLN2 Q96KS0 1/20 0.31
EGLN1 Q9GZT9 1/20 0.31
IDH1 O75874 1/20 0.31
POLB P06746 1/20 0.31
LMNA P02545 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
SCHEMBL7142405 0.93 NPC1 (0.32) NPC1RAB9A
SCHEMBL7148631 0.88 NPC1 (0.32) NPC1RAB9AEGLN2EGLN1
SCHEMBL9302503 0.86 CNR1 (0.34) NPC1RAB9A
SCHEMBL29371482 0.86 NPC1 (0.44) NPC1RAB9AIDH1POLBLMNA
SCHEMBL673358 0.86 NPC1 (0.44) NPC1RAB9AIDH1POLBLMNA
SCHEMBL7787074 0.84 CYP1A2 (0.38) NPC1RAB9AEGLN2EGLN1POLB
SCHEMBL8958781 0.82 NPC1 (0.35) NPC1RAB9AEGLN2EGLN1POLB
SCHEMBL7142407 0.82 CNR1 (0.32)
SCHEMBL7143461 0.81 ALDH1A1 (0.30)
SCHEMBL22164129 0.81 NPC1 (0.37) NPC1RAB9APOLBLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5278314-A N-Phenol-substituted benzotriazoles CIBA-GEIGY CORPORATION (US) 1994-01-11 US claimed
EP-0576527-A1 5-THIO-SUBSTITUTED BENZOTRIAZOLE UV-ABSORBERS AND STABILIZED COMPOSITIONS Ciba SC Holding AG (CH) 1994-01-05 EP claimed
WO-1992014718-A1 5-THIO-SUBSTITUTED BENZOTRIAZOLE UV-ABSORBERS AND STABILIZED COMPOSITIONS CIBA-GEIGY AG (CH) 1992-09-03 WO claimed