SCHEMBL9259895

SCHEMBL9259895

Oc1c(Cc2ccccc2)cc(Cc2ccccc2)cc1-n1nc2ccc(Br)cc2n1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 0.44
PTPN2 P17706 1/20 0.44
PTPN6 P29350 1/20 0.44
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
BCL2 P10415 2/20 0.36
BCL2L1 Q07817 1/20 0.36
LMNA P02545 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
CYP1A2 P05177 1/20 0.34
PTGER1 P34995 1/20 0.34
FPR1 P21462 1/20 0.34
FPR2 P25090 1/20 0.34

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
SCHEMBL5668000 0.90 PTPN1 (0.50) PTPN1PTPN2PTPN6NPC1RAB9A
SCHEMBL9268344 0.86 MEN1 (0.46) PTPN1PTPN2PTPN6NPC1RAB9A
SCHEMBL9264383 0.86 PTPN1 (0.43) PTPN1PTPN2PTPN6NPC1RAB9A
SCHEMBL74494 0.81 KDM4E (0.35) NPC1RAB9ALMNA
SCHEMBL9408845 0.81 NPC1 (0.42) PTPN1PTPN2PTPN6NPC1RAB9A
SCHEMBL74867 0.79 NPC1 (0.33) NPC1RAB9A
SCHEMBL7564694 0.78 NPC1 (0.35) NPC1RAB9A
SCHEMBL74481 0.78 NPC1 (0.33) NPC1RAB9A
SCHEMBL14323153 0.76 NPC1 (0.59) NPC1RAB9ABCL2BCL2L1LMNA
SCHEMBL11420200 0.75 HSPA5 (0.43) PTPN1PTPN2PTPN6NPC1RAB9A

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