SCHEMBL10859293

SCHEMBL10859293

COc1cc(C=C2CCn3c2nc2cc(NC(=O)C(Cl)=C(Cl)C(=O)O)ccc2c3=O)cc(OC)c1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.52
KMT2A Q03164 8/20 0.52
MEN1 O00255 7/20 0.52
RAB9A P51151 2/20 0.52
MAPT P10636 2/20 0.52
KDM4E B2RXH2 1/20 0.52
ALDH1A1 P00352 2/20 0.51
POLB P06746 1/20 0.51
THRB P10828 1/20 0.51
HPGD P15428 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
NPC1 O15118 1/20 0.49
NME2 P22392 1/20 0.47
MCL1 Q07820 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46

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
SCHEMBL10859289 1.00 ALOX5 (0.52) ALOX5KMT2AMEN1RAB9AMAPT
SCHEMBL10859278 1.00 ALOX5 (0.52) ALOX5KMT2AMEN1RAB9AMAPT
SCHEMBL10854723 0.93 KMT2A (0.54) ALOX5KMT2AMEN1RAB9AMAPT
SCHEMBL10854727 0.93 KMT2A (0.54) ALOX5KMT2AMEN1RAB9AMAPT
SCHEMBL10854721 0.93 KMT2A (0.54) ALOX5KMT2AMEN1RAB9AMAPT
SCHEMBL10855784 0.93 KMT2A (0.53) ALOX5KMT2AMEN1RAB9AMAPT
SCHEMBL10855790 0.93 KMT2A (0.53) ALOX5KMT2AMEN1RAB9AMAPT
SCHEMBL10855793 0.93 KMT2A (0.53) ALOX5KMT2AMEN1RAB9AMAPT
SCHEMBL10856932 0.92 ALOX5 (0.56) ALOX5KMT2AMEN1RAB9AMAPT
SCHEMBL10856912 0.92 ALOX5 (0.56) ALOX5KMT2AMEN1RAB9AMAPT

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-4579847-A Amino derivatives of benzylidene-pyrrolo[2,1-b]quinazolines useful for treating conditions of allergic origin FARMITALIA CARLO ERBA S.P.A. (IT) 1986-04-01 US disclosed