SCHEMBL11276307

SCHEMBL11276307

O=C(O)Cc1ccc2nc3ccc(Cl)cc3c(=O)n2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.55
ALDH1A1 P00352 4/20 0.55
HPGD P15428 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
CYP1A2 P05177 1/20 0.55
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
HSD17B10 Q99714 4/20 0.53
CASP1 P29466 3/20 0.53
CASP7 P55210 2/20 0.53
LMNA P02545 2/20 0.53
ALPG P10696 1/20 0.46
POLB P06746 1/20 0.44
HDAC3 O15379 1/20 0.44
HDAC4 P56524 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC10 Q969S8 1/20 0.44
HDAC11 Q96DB2 1/20 0.44

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
SCHEMBL11276381 0.91 MEN1 (0.59) KDM4EALDH1A1HPGDSMN1; SMN2CYP1A2
SCHEMBL11259140 0.88 KDM4E (0.55) KDM4EALDH1A1HPGDSMN1; SMN2CYP1A2
SCHEMBL11271741 0.82 KDM4E (0.45) KDM4EALDH1A1HPGDSMN1; SMN2CYP1A2
SCHEMBL11269694 0.82 ALPG (0.69) KDM4EALDH1A1HPGDSMN1; SMN2MEN1
SCHEMBL11267010 0.82 CTDSP1 (0.55) KDM4EALDH1A1HPGDSMN1; SMN2MEN1
SCHEMBL11089921 0.80 PTAFR (0.46) KDM4EALDH1A1HPGDSMN1; SMN2CYP1A2
SCHEMBL11263830 0.80 MEN1 (0.59) KDM4EALDH1A1HPGDSMN1; SMN2CYP1A2
SCHEMBL11259134 0.78 KDM4E (0.53) KDM4EALDH1A1HPGDSMN1; SMN2CYP1A2
SCHEMBL11263329 0.76 ALPG (0.58) KDM4EALDH1A1HPGDCYP1A2MEN1
SCHEMBL11090785 0.73 KDM4E (0.48) KDM4EALDH1A1HPGDSMN1; SMN2CYP1A2

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-4348396-A Substituted 11-oxo-11H-pyrido[2,1-b]quinazolines and method of inhibiting allergic reactions with them HOFFMANN-LA ROCHE INC. (US) 1982-09-07 US disclosed