SCHEMBL30008096

SCHEMBL30008096

Clc1ccc2c(oc3ccccc32)c1Br

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 4/20 0.51
SMN1; SMN2 Q16637 3/20 0.42
ALOX5 P09917 3/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2A6 P11509 1/20 0.38
KDM4E B2RXH2 3/20 0.38
ALDH1A1 P00352 3/20 0.38
MAPT P10636 3/20 0.38
HPGD P15428 3/20 0.38
MAOA P21397 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
TTR P02766 1/20 0.38
PGR P06401 1/20 0.37
PTGS2 P35354 1/20 0.37
DYRK1A Q13627 1/20 0.37
GLA P06280 1/20 0.36
CYP3A4 P08684 1/20 0.36
PGAM1 P18669 1/20 0.36
CASP1 P29466 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
SCHEMBL22883938 1.00 AHR (0.51) AHRSMN1; SMN2ALOX5CYP1A2CYP2A6
SCHEMBL29897734 0.81 AHR (0.42) AHRSMN1; SMN2ALOX5KDM4EALDH1A1
SCHEMBL18732156 0.80 ALOX5 (0.51) AHRSMN1; SMN2ALOX5PIM1CSNK2A2
SCHEMBL12925908 0.78 AHR (0.51) AHRSMN1; SMN2ALOX5CYP1A2CYP2A6
SCHEMBL22316643 0.78 AHR (0.51) AHRSMN1; SMN2ALOX5CYP1A2CYP2A6
SCHEMBL23611394 0.78 AHR (0.51) AHRSMN1; SMN2ALOX5CYP1A2CYP2A6
SCHEMBL22233752 0.78 AHR (0.51) AHRSMN1; SMN2ALOX5CYP1A2CYP2A6
SCHEMBL23623460 0.78 AHR (0.51) AHRSMN1; SMN2ALOX5CYP1A2CYP2A6
SCHEMBL20321533 0.78 AHR (0.43) AHRSMN1; SMN2ALOX5KDM4EALDH1A1
SCHEMBL30985275 0.78 AHR (0.51) AHRSMN1; SMN2ALOX5CYP1A2CYP2A6

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-115461348-A Organic molecules for optoelectronic devices 三星显示有限公司 2022-12-09 CN disclosed
CN-115443280-A Organic molecules for optoelectronic devices 三星显示有限公司 2022-12-06 CN disclosed