SCHEMBL7247270

SCHEMBL7247270

Nc1ccc(-c2c3nc(c(-c4ccncc4)c4ccc([nH]4)c(-c4ccncc4)c4nc(c(-c5ccncc5)c5ccc2[nH]5)C=C4)C=C3)cc1

nearest known ligand 0.97

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 4/20 0.97
▸ CYCS P99999 3/20 0.51
▸ TERT O14746 4/20 0.50
▸ ENPP2 Q13822 1/20 0.50
▸ ABCG2 Q9UNQ0 1/20 0.44
▸ MAPK13 O15264 2/20 0.43
▸ MAPK12 P53778 2/20 0.43
▸ MAPK11 Q15759 2/20 0.43
▸ MAPK14 Q16539 2/20 0.43
▸ ALOX5 P09917 1/20 0.43
▸ GCGR P47871 1/20 0.43
▸ IMPDH2 P12268 1/20 0.43

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
SCHEMBL7705564 1.00 TOP1 (0.97) TOP1CYCSTERTENPP2ABCG2
SCHEMBL3424111 0.92 TOP1 (0.81) TOP1CYCSTERTENPP2ABCG2
SCHEMBL7247327 0.90 TOP1 (0.80) TOP1CYCSTERTENPP2ABCG2
SCHEMBL31463631 0.90 TOP1 (0.79) TOP1CYCSTERTENPP2ABCG2
Hydrochloric Acid SCHEMBL8908213 0.90 TOP1 (0.79) TOP1CYCSTERTENPP2ABCG2
SCHEMBL31463633 0.90 TOP1 (0.79) TOP1CYCSTERTENPP2ABCG2
SCHEMBL16438041 0.90 TOP1 (0.79) TOP1CYCSTERTENPP2ABCG2
SCHEMBL3802533 0.90 TOP1 (0.79) TOP1CYCSTERTENPP2ABCG2
SCHEMBL31337529 0.90 TOP1 (0.79) TOP1CYCSTERTENPP2ABCG2
SCHEMBL31337498 0.90 TOP1 (0.79) TOP1CYCSTERTENPP2ABCG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030203888-A1 Chromophores WELLCOME TRUST LIMITED, THE (GB) 2003-10-30 — — US disclosed
US-20030105130-A1 Thiaporphyrin, selenaporphyrin, and carotenoid porphyrin compounds as c-myc and telomerase inhibitors NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2003-06-05 — — US disclosed
EP-1294726-A2 IMPROVEMENTS IN AND RELATING TO CHROMOPHORES Catalyst Biomedica Ltd (GB) 2003-03-26 — — EP disclosed
WO-2002000662-A1 IMPROVEMENTS IN AND RELATING TO CHROMOPHORES CATALYST BIOMEDICA LIMITED (GB) 2002-01-03 — — WO disclosed
EP-0345171-B1 Metalloporphyrine derivatives, their therapeutical use and their use in the preparation of hybrid molecules CENTRE NAT RECH SCIENT (FR) 1995-12-13 — — EP disclosed
EP-0345171-A1 Metalloporphyrine derivatives, their therapeutical use and their use in the preparation of hybrid molecules CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 1989-12-06 — — EP 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 (2 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-20030203888-A1 Chromophores HCCS, PPOX, HMBS TOP1 1754/4885CYCS 115/4885TERT 3093/4885
US-20030105130-A1 Thiaporphyrin, selenaporphyrin, and carotenoid porphyrin compounds as c-myc and telomerase inhibitors MYCBP, MYC, TERF2IP TOP1 132/4885CYCS 805/4885TERT 5/4885

“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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