SCHEMBL27642016

SCHEMBL27642016

O=C(O)Cc1cc(Cl)ccc1Cc1cccc2c1Cc1ccccc1-2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.47
PNMT P11086 1/20 0.45
AKR1B1 P15121 2/20 0.41
CXCL8 P10145 1/20 0.41
CYP2C9 P11712 1/20 0.41
CHRM1 P11229 1/20 0.41
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
SUCNR1 Q9BXA5 4/20 0.37
TBXA2R P21731 2/20 0.37
PTGFR P43088 1/20 0.37
PTGER3 P43115 1/20 0.37
PTGER2 P43116 1/20 0.37
PTGIR P43119 1/20 0.37
PTGDR Q13258 1/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
GAA P10253 1/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.37
GRIK1 P39086 1/20 0.36

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
SCHEMBL225715 0.82 PNMT (0.60) HSP90AA1PNMTAKR1B1NPC1RAB9A
SCHEMBL7195192 0.76 PNMT (0.72) PNMTNPC1RAB9AMEN1KMT2A
SCHEMBL28492879 0.74 TDP1 (0.53) HSP90AA1PNMTAKR1B1CXCL8NPC1
SCHEMBL7606240 0.74 PNMT (0.70) PNMTNPC1RAB9AMEN1KMT2A
SCHEMBL7607164 0.74 PNMT (0.70) PNMTNPC1RAB9AMEN1KMT2A
SCHEMBL28300801 0.74 AKR1B1 (0.50) HSP90AA1PNMTAKR1B1CYP2C9NPC1
Hydrochloric Acid SCHEMBL5353661 0.73 PNMT (0.68) PNMTNPC1RAB9AMEN1KMT2A
Hydrochloric Acid SCHEMBL5353647 0.73 PNMT (0.68) PNMTNPC1RAB9AMEN1KMT2A
Hydrochloric Acid SCHEMBL5352118 0.73 PNMT (0.68) PNMTNPC1RAB9AMEN1KMT2A
SCHEMBL20402095 0.72 PNMT (0.55) PNMTAKR1B1NPC1RAB9APTGER3

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
CN-1743348-A Catalyst component for olefinic polymerization and its catalyst CHINA PETROCHEMICAL CORP (CN) 2006-03-08 CN disclosed
CN-1743346-A Catalyst component for olefinic polymerization and its catalyst CHINA PETROCHEMICAL CORP (CN) 2006-03-08 CN disclosed