SCHEMBL18016429

SCHEMBL18016429

Cc1ccc(-c2c3nc(c(-c4cc[n+](C)cc4)c4ccc([nH]4)c(-c4cc[n+](C)cc4)c4nc(c(-c5cc[n+](C)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1

nearest known ligand 0.82

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 6/20 0.82
▸ TOP1 P11387 4/20 0.50
▸ CYCS P99999 3/20 0.49
▸ ABCG2 Q9UNQ0 1/20 0.48
▸ ENPP2 Q13822 1/20 0.48

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
Tmpyp4 SCHEMBL265519 0.92 TERT (0.97) TERTTOP1CYCSABCG2ENPP2
Tmpyp4 SCHEMBL29369473 0.91 TERT (1.00) TERTTOP1CYCSABCG2ENPP2
Tmpyp4 SCHEMBL20380171 0.91 TERT (0.93) TERTTOP1CYCSABCG2ENPP2
SCHEMBL29693624 0.89 TERT (0.62) TERTTOP1CYCSABCG2ENPP2
SCHEMBL242168 0.89 TERT (0.62) TERTTOP1CYCSABCG2ENPP2
SCHEMBL25407804 0.87 TERT (0.65) TERTTOP1CYCSABCG2ENPP2
SCHEMBL31182124 0.87 TERT (0.60) TERTTOP1CYCSABCG2ENPP2
SCHEMBL31268231 0.87 TERT (0.60) TERTTOP1CYCSABCG2ENPP2
SCHEMBL31040346 0.87 TERT (0.60) TERTTOP1CYCSABCG2ENPP2
SCHEMBL31375135 0.87 TERT (0.60) TERTTOP1CYCSABCG2ENPP2

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-20160235865-A1 PROSTATE-SPECIFIC MEMBRANE ANTIGEN-TARGETED PHOTOSENSITIZERS FOR PHOTODYNAMIC THERAPY THE JOHNS HOPKINS UNIVERSITY (US) 2016-08-18 — — US 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-20160235865-A1 PROSTATE-SPECIFIC MEMBRANE ANTIGEN-TARGETED PHOTOSENSITIZERS FOR PHOTODYNAMIC THERAPY FOLH1, KLK3, UROD TERT 4221/4885TOP1 2383/4885CYCS 4344/4885

“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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