SCHEMBL28903307

SCHEMBL28903307

[CH2]c1cc(=O)n2ccc(Br)cc2n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.44
ALDH1A1 P00352 2/20 0.44
METTL3 Q86U44 2/20 0.37
AHR P35869 2/20 0.35
AKT2 P31751 1/20 0.32
CASP3 P42574 1/20 0.32
LMNA P02545 2/20 0.31
POLB P06746 1/20 0.31
GRM5 P41594 1/20 0.31
ADORA3 P0DMS8 1/20 0.31
ADORA2A P29274 1/20 0.31
ADORA2B P29275 1/20 0.31
ADORA1 P30542 1/20 0.31
PRKDC P78527 1/20 0.31
PKM P14618 1/20 0.30
PSD A5PKW4 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL18015431 0.79 KDM4E (0.70) KDM4EALDH1A1METTL3AHRCASP3
SCHEMBL23726440 0.77 METTL3 (0.46) KDM4EALDH1A1METTL3AHRLMNA
SCHEMBL28903295 0.76 KDM4E (0.47) KDM4EALDH1A1AHRLMNAPOLB
SCHEMBL23725727 0.76 KDM4E (0.43) KDM4EALDH1A1METTL3AHRLMNA
SCHEMBL23414795 0.76 ALDH1A1 (0.41) KDM4EALDH1A1METTL3LMNAPOLB
SCHEMBL18015437 0.74 RAB9A (0.51) KDM4EALDH1A1AKT2CASP3POLB
SCHEMBL23726231 0.73 KDM4E (0.38) KDM4EALDH1A1AHRAKT2CASP3
SCHEMBL28903524 0.72 KDM4E (0.41) KDM4EALDH1A1AHRCASP3LMNA
SCHEMBL18015434 0.71 ADORA3 (0.55) KDM4EALDH1A1METTL3AHRGRM5
SCHEMBL23726594 0.67 MAPT (0.41) KDM4EALDH1A1LMNAPOLBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115413275-A Substituted 1,1 , -biphenyl compounds and methods of use thereof 爱彼特生物制药公司 2022-11-29 CN disclosed