SCHEMBL4499323

SCHEMBL4499323

CC(=O)N1C(=O)/C(=C(/O)c2ccc(O)c([N+](=O)[O-])c2)c2ccc(Cl)cc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.37
KMT2A Q03164 5/20 0.37
MAPT P10636 4/20 0.37
ALDH1A1 P00352 2/20 0.37
CRHBP P24387 1/20 0.37
CRHR2 Q13324 1/20 0.37
MAPK1 P28482 2/20 0.36
GAA P10253 1/20 0.36
KCNMA1 Q12791 2/20 0.36
POLB P06746 2/20 0.36
LMNA P02545 1/20 0.36
HPGD P15428 1/20 0.36
AURKB Q96GD4 1/20 0.36
DPP4 P27487 1/20 0.36
PREP P48147 1/20 0.36
DPP9 Q86TI2 1/20 0.36
VCAM1 P19320 1/20 0.36
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
HSD11B1 P28845 1/20 0.35

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
SCHEMBL4499325 1.00 MEN1 (0.37) MEN1KMT2AMAPTALDH1A1CRHBP
SCHEMBL4487910 0.87 DPP4 (0.38) MEN1KMT2AMAPTALDH1A1CRHBP
SCHEMBL4487914 0.87 DPP4 (0.38) MEN1KMT2AMAPTALDH1A1CRHBP
SCHEMBL3935351 0.86 KMT2A (0.44) MEN1KMT2AMAPTKCNMA1LMNA
SCHEMBL3935358 0.86 KMT2A (0.44) MEN1KMT2AMAPTKCNMA1LMNA
SCHEMBL4480297 0.85 CES1 (0.41) MEN1KMT2AALDH1A1MAPK1LMNA
SCHEMBL4480293 0.85 CES1 (0.41) MEN1KMT2AALDH1A1MAPK1LMNA
SCHEMBL3526300 0.82 CES1 (0.40) MEN1KMT2AALDH1A1HPGDCES2
SCHEMBL3526299 0.82 CES1 (0.40) MEN1KMT2AALDH1A1HPGDCES2
SCHEMBL3529306 0.78 CES1 (0.37) MEN1KMT2AMAPTALDH1A1CES1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7514468-B2 Indolinone derivatives substituted in the 6 position, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2009-04-07 US disclosed
US-20060194813-A1 Indolinone derivatives substituted in the 6 position, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2006-08-31 US disclosed
EP-1527046-A1 INDOLINE DERIVATIVES SUBSTITUTED IN POSITION 6, PRODUCTION AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2005-05-04 EP disclosed
WO-2004009546-A1 INDOLINE DERIVATIVES SUBSTITUTED IN POSITION 6, PRODUCTION AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-01-29 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060194813-A1 Indolinone derivatives substituted in the 6 position, the preparation thereof and their use as pharmaceutical compositions KDR, FLT1, EGFR MEN1 1288/4885KMT2A 3530/4885MAPT 545/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.