SCHEMBL11276381

SCHEMBL11276381

O=C(O)Cc1ccc2nc3cc(Cl)ccc3c(=O)n2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
KDM4E B2RXH2 4/20 0.53
ALDH1A1 P00352 4/20 0.53
CASP1 P29466 3/20 0.53
HSD17B10 Q99714 3/20 0.53
GAA P10253 1/20 0.53
POLB P06746 1/20 0.52
AKR1B1 P15121 1/20 0.50
TBXAS1 P24557 1/20 0.49
PTAFR P25105 1/20 0.49
HPGD P15428 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
CYP1A2 P05177 1/20 0.47
CASP7 P55210 2/20 0.45
LMNA P02545 1/20 0.45
CTDSP1 Q9GZU7 1/20 0.41
CYP3A4 P08684 1/20 0.40
EGFR P00533 3/20 0.40
ALPG P10696 1/20 0.40

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
SCHEMBL11276307 0.91 KDM4E (0.55) MEN1KMT2AKDM4EALDH1A1CASP1
SCHEMBL11263830 0.88 MEN1 (0.59) MEN1KMT2AKDM4EALDH1A1CASP1
SCHEMBL11267010 0.83 CTDSP1 (0.55) MEN1KMT2AKDM4EALDH1A1CASP1
SCHEMBL11263329 0.82 ALPG (0.58) MEN1KMT2AKDM4EALDH1A1CASP1
SCHEMBL11259140 0.80 KDM4E (0.55) MEN1KMT2AKDM4EALDH1A1CASP1
SCHEMBL11263826 0.79 MEN1 (0.52) MEN1KMT2AKDM4EALDH1A1CASP1
SCHEMBL11269694 0.76 ALPG (0.69) MEN1KMT2AKDM4EALDH1A1CASP1
SCHEMBL11089921 0.74 PTAFR (0.46) MEN1KMT2AKDM4EALDH1A1CASP1
SCHEMBL11271741 0.74 KDM4E (0.45) MEN1KMT2AKDM4EALDH1A1CASP1
SCHEMBL11271921 0.72 ALPG (0.57) MEN1KMT2AKDM4EALDH1A1CASP1

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