SCHEMBL29976335

SCHEMBL29976335

CSc1nc(Cl)cc(C(C)(F)F)n1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.42
KMT2A Q03164 4/20 0.41
MEN1 O00255 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
GAA P10253 1/20 0.41
HTT P42858 1/20 0.40
PPARG P37231 1/20 0.33
KDM4E B2RXH2 2/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL19806100 1.00 POLB (0.42) POLBKMT2AMEN1SMN1; SMN2GAA
SCHEMBL254039 0.86 POLB (0.44) POLBKMT2AMEN1SMN1; SMN2GAA
SCHEMBL5750658 0.84 POLB (0.45) POLBKMT2AMEN1SMN1; SMN2GAA
SCHEMBL19805997 0.80 HTT (0.43) POLBKMT2AMEN1SMN1; SMN2GAA
SCHEMBL62021 0.79 POLB (0.53) POLBKMT2AMEN1SMN1; SMN2GAA
SCHEMBL113146 0.78 HRH4 (0.35) SMN1; SMN2
SCHEMBL30809049 0.78 HRH4 (0.35) SMN1; SMN2
SCHEMBL31543344 0.76 ALDH1A1 (0.36) KMT2AMEN1ALDH1A1
SCHEMBL30808934 0.74 IDH1 (0.30)
SCHEMBL19024133 0.74 IDH1 (0.30)

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-110023292-B Apoptosis inhibitors 北京生命科学研究所 2022-10-04 CN disclosed