SCHEMBL13201028

SCHEMBL13201028

O=C(Nc1ccccc1)c1ncccc1O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATR Q13535 3/20 0.61
EGLN2 Q96KS0 1/20 0.59
FTO Q9C0B1 1/20 0.59
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
KDM4E B2RXH2 3/20 0.56
HPGD P15428 2/20 0.56
HTT P42858 2/20 0.56
LMNA P02545 1/20 0.56
TP53 P04637 1/20 0.56
HSD17B10 Q99714 1/20 0.56
PRKCI P41743 1/20 0.55
ALDH1A1 P00352 2/20 0.54
GAA P10253 1/20 0.54
MAPT P10636 1/20 0.54
PIM1 P11309 1/20 0.53
GRM4 Q14833 1/20 0.53
CSF1R P07333 1/20 0.53
RET P07949 1/20 0.53
PDGFRB P09619 1/20 0.53

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
SCHEMBL5583624 0.87 EGLN2 (0.54) ATREGLN2FTOMEN1KMT2A
SCHEMBL5583780 0.87 PNLIP (0.63) KMT2AHPGDLMNATP53MAPT
SCHEMBL18027788 0.85 KDM4E (0.73) EGLN2FTOKDM4EHTTLMNA
SCHEMBL14284354 0.85 TLR7 (0.67) EGLN2FTOKDM4EHTTLMNA
SCHEMBL18993449 0.85 CSF1R (0.53) ATREGLN2FTOKDM4EPRKCI
SCHEMBL14284353 0.82 GRM4 (0.73) MEN1KMT2AHTTLMNAALDH1A1
SCHEMBL259103 0.82 ELANE (0.58) MEN1KMT2AKDM4ELMNATP53
SCHEMBL18010076 0.82 CSF1R (0.50) ATREGLN2FTOKDM4EPRKCI
SCHEMBL5936350 0.81 HTT (0.60) ATRMEN1KMT2AKDM4EHPGD
SCHEMBL7974510 0.81 ATR (0.59) ATRMEN1KMT2AKDM4EHTT

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-7767670-B2 Substituted 3-carboxamido isoxazoles as kinase modulators AMBIT BIOSCIENCES CORPORATION (US) 2010-08-03 US disclosed