SCHEMBL5259049

SCHEMBL5259049

N#Cc1cc(C(=O)c2ccccc2)n2ccccc12

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ FNTA P49354 9/20 0.62
▸ FNTB P49356 9/20 0.62
▸ KMT2A Q03164 1/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.42
▸ HTT P42858 1/20 0.41
▸ BAZ2B Q9UIF8 2/20 0.40
▸ BAZ2A Q9UIF9 2/20 0.40
▸ PTPN1 P18031 1/20 0.40
▸ CDC25A P30304 1/20 0.40
▸ DUSP3 P51452 1/20 0.40
▸ BRD4 O60885 1/20 0.39
▸ BRD2 P25440 1/20 0.39
▸ BRD3 Q15059 1/20 0.39

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
SCHEMBL17339134 0.86 FNTA (0.48) FNTAFNTBKMT2AHTTBAZ2B
SCHEMBL26301414 0.78 FNTA (0.69) FNTAFNTBHTTBAZ2BBAZ2A
SCHEMBL27795128 0.77 EGFR (0.46) FNTAFNTBKMT2AHTTBAZ2B
SCHEMBL25402450 0.77 FNTA (0.68) FNTAFNTBKMT2AHTTBAZ2B
SCHEMBL5310989 0.76 PTPN1 (0.44) FNTAFNTBNPSR1PTPN1CDC25A
SCHEMBL27696466 0.75 ALDH1A1 (0.40) FNTAFNTBKMT2ABAZ2BBAZ2A
SCHEMBL17339104 0.75 KDM4E (0.52) FNTAFNTBKMT2ANPSR1
SCHEMBL6221151 0.75 FNTA (0.50) FNTAFNTBKMT2AHTT
SCHEMBL26301880 0.73 FNTA (0.67) FNTAFNTBNPSR1BAZ2BBAZ2A
SCHEMBL543429 0.73 RORC (0.40) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1578424-A4 SUBSTITUTED 1-BENZOYL-3-CYANO-PYRROLO 1,2-A| QUINOLINES AND ANALOGS AS ACTIVATORS OF CASPASES AND INDUCERS OF APOPTOSIS CYTOVIA INC (US) 2007-08-08 — — EP disclosed
US-7135480-B2 Anticarcinogenic agents; colon, lymphoma, lung, prostate and breast cancers CYTOVIA, INC. (US) 2006-11-14 — — US disclosed
EP-1578424-A2 SUBSTITUTED 1-BENZOYL-3-CYANO-PYRROLO 1,2-A] QUINOLINES AND ANALOGS AS ACTIVATORS OF CASPASES AND INDUCERS OF APOPTOSIS Cytovia, Inc. (US) 2005-09-28 — — EP disclosed
US-20050014759-A1 Substituted 1-benzoyl-3-cyano-pyrrolo [1,2-a] quinolines and analogs as activators of caspases and inducers of apoptosis CYTOVIA, INC. 2005-01-20 — — US disclosed
WO-2004055163-A2 SUBSTITUTED 1-BENZOYL-3-CYANO-PYRROLO[1,2-A]QUINOLINES CYTOVIA, INC. (US) 2004-07-01 — — 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-20050014759-A1 Substituted 1-benzoyl-3-cyano-pyrrolo [1,2-a] quinolines and analogs as activators of caspases and inducers of apoptosis CASP3, CASP7, CASP1 FNTA 4636/4885FNTB 4626/4885KMT2A 1411/4885

“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.

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