SCHEMBL9258342

SCHEMBL9258342

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

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 4/20 0.42
GABRA1 P14867 4/20 0.41
GABRB2 P47870 2/20 0.41
GABRB1 P18505 3/20 0.40
NPC1 O15118 4/20 0.39
RAB9A P51151 4/20 0.39
POLB P06746 2/20 0.39
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
DHODH Q02127 1/20 0.33
LMNA P02545 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
FABP3 P05413 2/20 0.31
CASP3 P42574 1/20 0.31
SENP8 Q96LD8 1/20 0.31
SENP7 Q9BQF6 1/20 0.31

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
SCHEMBL9265708 0.86 GABRA1 (0.46) FABP4GABRA1GABRB2GABRB1NPC1
SCHEMBL9267379 0.85 GABRA1 (0.42) FABP4GABRA1GABRB2GABRB1NPC1
SCHEMBL4357048 0.84 NPC1 (0.50) FABP4GABRA1GABRB2GABRB1NPC1
SCHEMBL9269913 0.84 NPC1 (0.42) FABP4GABRA1GABRB2GABRB1NPC1
SCHEMBL9268510 0.80 GABRA1 (0.50) FABP4GABRA1GABRB2GABRB1NPC1
SCHEMBL9408167 0.80 GABRA1 (0.46) FABP4GABRA1GABRB2GABRB1NPC1
SCHEMBL27504752 0.74 NPC1 (0.40) GABRA1GABRB2NPC1RAB9APOLB
SCHEMBL27451185 0.74 NPC1 (0.40) GABRA1GABRB1NPC1RAB9APOLB
SCHEMBL28371173 0.73 NPC1 (0.55) NPC1RAB9APOLBMEN1ALDH1A1
SCHEMBL9264904 0.73 NPC1 (0.55) NPC1RAB9APOLBMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5410071-A Sulfiding with a thiophenolic compound or a thiophenolate in a polar solvent to form a stabilizers for polyphenylene sulfide against UV radiation PHILLIPS PETROLEUM COMPANY (US) 1995-04-25 US disclosed
US-5319091-A Contacting sulfur-containing aromatic compound with hydroxyphenylbenzotriazole derivative in presence of polar organic compound, oxidizing formed aryl sulfide derivative to sulfone, sulfoxide or mixtures PHILLIPS PETROLEUM COMPANY (US) 1994-06-07 US disclosed
EP-0599269-A1 Compositions comprising sulfur-containing derivatives of hydroxyphenylbenzotriazole and process therefor PHILLIPS PETROLEUM COMPANY (US) 1994-06-01 EP disclosed
US-5274015-A And a polyarylene sulfide polymer PHILLIPS PETROLEUM COMPANY (US) 1993-12-28 US disclosed
US-5268450-A Reating sodium hydrosulfide with a sulfur containing hydroxyphenylbenztriazole PHILLIPS PETROLEUM COMPANY (US) 1993-12-07 US disclosed