SCHEMBL7905115

SCHEMBL7905115

Clc1cc(Br)c2[nH]c(-c3ccccc3)cc2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.54
RAB9A P51151 5/20 0.54
ALDH1A1 P00352 5/20 0.54
KDM4E B2RXH2 5/20 0.54
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
CYP19A1 P11511 3/20 0.54
MAPT P10636 3/20 0.54
LMNA P02545 3/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
HPGD P15428 3/20 0.44
CYP1A2 P05177 2/20 0.44
CYP2C19 P33261 2/20 0.44
CASP3 P42574 2/20 0.44
SENP8 Q96LD8 2/20 0.44
SENP7 Q9BQF6 2/20 0.44
SENP6 Q9GZR1 2/20 0.44
CYP2C9 P11712 1/20 0.44
DHODH Q02127 1/20 0.41
NPY5R Q15761 3/20 0.39

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
SCHEMBL3985467 0.83 ALDH1A1 (0.57) NPC1RAB9AALDH1A1KDM4EMEN1
SCHEMBL7919004 0.83 CYP19A1 (0.57) NPC1RAB9AALDH1A1KDM4EMEN1
SCHEMBL3976721 0.80 ALDH1A1 (0.54) NPC1RAB9AALDH1A1KDM4EMEN1
SCHEMBL3012783 0.80 ALDH1A1 (0.54) NPC1RAB9AALDH1A1KDM4EMEN1
SCHEMBL16835575 0.77 DHODH (0.55) NPC1RAB9AALDH1A1KDM4EMEN1
SCHEMBL505688 0.74 DHODH (0.68) NPC1RAB9AALDH1A1KDM4EMEN1
SCHEMBL2999852 0.74 CYP19A1 (0.49) NPC1RAB9AALDH1A1KDM4EMEN1
SCHEMBL12324064 0.72 NPC1 (0.59) NPC1RAB9AALDH1A1KDM4EMEN1
SCHEMBL6117859 0.70 MEN1 (1.00) NPC1RAB9AALDH1A1KDM4EMEN1
SCHEMBL7650453 0.70 DHODH (0.55) NPC1RAB9AALDH1A1KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0872903-B1 Method for making hydrogen storage alloy powder and electrode comprising the alloy powder SHINETSU CHEMICAL CO (JP) 2001-10-04 EP disclosed
US-6277519-B1 QUENCHING AN ALLOY MELT; COMMINUTION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2001-08-21 US disclosed
US-6096144-A TREATING WITH ACIDIC OR ALKALINE SOLUTION OF CONJUGATED UNSATURATED COMPOUND WITH AT LEAST 5 BONDS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2000-08-01 US disclosed
US-5858571-A TREATING A PULVERIZED HYDROGEN ABSORBING ALLOY WITH A SOLUTION COMPRISING A CONJUGATED UNSATURATED COMPOUND SHIN-ETSU CHEMICAL CO., LTD. (JP) 1999-01-12 US disclosed
EP-0872903-A1 Method for making hydrogen storage alloy powder and electrode comprising the alloy powder Shin-Etsu Chemical Co., Ltd. (JP) 1998-10-21 EP disclosed
EP-0172427-B1 PROCESS FOR PRODUCTION OF VINYL CHLORIDE POLYMER Shin-Etsu Chemical Co., Ltd. (JP) 1989-07-05 EP disclosed
US-4758639-A Process for production of vinyl polymer SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-19 US disclosed
US-4757124-A Suspension or emulsion polymerizing vinyl chloride monomer or mixture of vinyl chloride with vinyl monomer copolymerizable therewith in reactor with walls coated with antiscaling compound containing dye or pigments SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-12 US disclosed
EP-0172427-A2 Process for production of vinyl chloride polymer Shin-Etsu Chemical Co., Ltd. (JP) 1986-02-26 EP disclosed