SCHEMBL8927401

SCHEMBL8927401

Cc1nn(CC(O)c2ccc(Cl)cc2)c(=O)n1-c1ccc(N2CCN(c3ncc(O)cn3)CC2)cc1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.45
KMT2A Q03164 1/20 0.45
LMNA P02545 1/20 0.42
MAPT P10636 3/20 0.41
ADRB2 P07550 1/20 0.39
ADRB1 P08588 1/20 0.39
ADRB3 P13945 1/20 0.39
ADRA1D P25100 1/20 0.39
ADRA1A P35348 1/20 0.39
ADRA1B P35368 1/20 0.39
TP53 P04637 2/20 0.39
DEGS1 O15121 1/20 0.39
BRD9 Q9H8M2 1/20 0.38
BCHE P06276 1/20 0.36
CHRNE Q04844 1/20 0.36
HTR1A P08908 1/20 0.36
KCNH2 Q12809 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
SCHEMBL9457262 0.90 POLB (0.50) POLBKMT2ALMNAMAPTADRB2
Water SCHEMBL9457015 0.89 POLB (0.49) POLBKMT2ALMNAMAPTADRB2
SCHEMBL8927049 0.83 POLB (0.47) POLBKMT2ALMNAMAPTTP53
SCHEMBL8811666 0.77 KMT2A (0.54) POLBKMT2AMAPTTP53BCHE
SCHEMBL8931753 0.76 L3MBTL1 (0.41) POLBMAPTADRB2ADRB1ADRB3
SCHEMBL27407057 0.74 ADRB2 (0.38) KMT2AMAPTADRB2ADRB1ADRB3
SCHEMBL8927581 0.73 POLB (0.36) POLBKMT2ALMNAMAPTTP53
SCHEMBL9456969 0.72 POLB (0.52) POLBKMT2ALMNAMAPTTP53
SCHEMBL11070469 0.70 BRD9 (0.54) POLBKMT2ALMNAMAPTBRD9
SCHEMBL9462045 0.69 MAPT (0.45) POLBKMT2ALMNAMAPTTP53

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
US-5607932-A Heterocyclic derivatives of azolones JANSSEN PHARMACEUTICA N.V. (BE) 1997-03-04 US disclosed