SCHEMBL8927049

SCHEMBL8927049

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

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.47
KMT2A Q03164 3/20 0.47
BCHE P06276 1/20 0.45
CHRNE Q04844 1/20 0.45
MEN1 O00255 2/20 0.44
LMNA P02545 2/20 0.43
DEGS1 O15121 1/20 0.42
TP53 P04637 1/20 0.42
RAB9A P51151 3/20 0.42
NPC1 O15118 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CYP2C19 P33261 1/20 0.40
MAPT P10636 1/20 0.40
BRD9 Q9H8M2 1/20 0.39

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
SCHEMBL9456969 0.90 POLB (0.52) POLBKMT2ABCHECHRNEMEN1
SCHEMBL8811666 0.90 KMT2A (0.54) POLBKMT2ABCHECHRNEMEN1
SCHEMBL9457409 0.83 KMT2A (0.66) POLBKMT2ABCHECHRNEMEN1
SCHEMBL8927401 0.83 POLB (0.45) POLBKMT2ABCHECHRNELMNA
SCHEMBL10277001 0.79 MEN1 (0.47) POLBKMT2AMEN1LMNADEGS1
SCHEMBL8810087 0.75 KMT2A (0.39) POLBKMT2ABCHECHRNEMEN1
SCHEMBL9457262 0.72 POLB (0.50) POLBKMT2ABCHECHRNELMNA
SCHEMBL11070469 0.72 BRD9 (0.54) POLBKMT2AMEN1LMNASMN1; SMN2
SCHEMBL8927579 0.72 KMT2A (0.40) POLBKMT2ABCHECHRNEMEN1
Water SCHEMBL9457015 0.71 POLB (0.49) POLBKMT2ABCHECHRNELMNA

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