SCHEMBL5311850

SCHEMBL5311850

N#Cc1cc(C(=O)c2ccccc2)n2c1ccc1c(Cl)cccc12

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 2/20 0.43
▸ CDC25A P30304 2/20 0.43
▸ DUSP3 P51452 2/20 0.43
▸ FNTA P49354 7/20 0.39
▸ FNTB P49356 7/20 0.39
▸ CMA1 P23946 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ CNR2 P34972 1/20 0.36
▸ SLC22A12 Q96S37 1/20 0.35
▸ NOTUM Q6P988 1/20 0.35
▸ STAT3 P40763 1/20 0.34
▸ ELANE P08246 1/20 0.34

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
SCHEMBL5259057 0.90 KDM4E (0.38) PTPN1CDC25ADUSP3FNTAFNTB
SCHEMBL5259688 0.87 PTPN1 (0.44) PTPN1CDC25ADUSP3FNTAFNTB
SCHEMBL18333468 0.86 PTPN1 (0.34) PTPN1CDC25ADUSP3FNTAFNTB
SCHEMBL5259114 0.82 PTPN1 (0.41) PTPN1CDC25ADUSP3FNTAFNTB
SCHEMBL5259574 0.82 HTR2A (0.41) NOTUM
SCHEMBL5310989 0.81 PTPN1 (0.44) PTPN1CDC25ADUSP3FNTAFNTB
SCHEMBL5959279 0.80 MEN1 (0.40) PTPN1CDC25ADUSP3FNTAFNTB
SCHEMBL5959233 0.78 PTPN1 (0.42) PTPN1CDC25ADUSP3FNTAFNTB
SCHEMBL5959251 0.77 FNTA (0.44) PTPN1CDC25ADUSP3FNTAFNTB
SCHEMBL5309804 0.76 PTPN1 (0.42) PTPN1CDC25ADUSP3FNTAFNTB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7135480-B2 Anticarcinogenic agents; colon, lymphoma, lung, prostate and breast cancers CYTOVIA, INC. (US) 2006-11-14 — — US claimed
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 claimed
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 PTPN1 578/4885CDC25A 31/4885DUSP3 3852/4885

“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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