SCHEMBL17906174

SCHEMBL17906174

ICCCc1ccc(-c2c3nc(c(-c4ccccc4)c4ccc([nH]4)c(-c4ccc(CCCI)cc4)c4nc(c(-c5ccccc5)c5ccc2[nH]5)C=C4)C=C3)cc1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 4/20 0.49
▸ CYCS P99999 4/20 0.48
▸ STAT3 P40763 1/20 0.46
▸ STAT1 P42224 1/20 0.46
▸ ENPP2 Q13822 1/20 0.44
▸ TERT O14746 4/20 0.43
▸ ABCG2 Q9UNQ0 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
SCHEMBL17906202 0.99 CYCS (0.49) TOP1CYCSSTAT3STAT1ENPP2
SCHEMBL17904261 0.94 TERT (0.44) TOP1CYCSSTAT3STAT1ENPP2
SCHEMBL17904267 0.93 CYCS (0.44) TOP1CYCSSTAT3STAT1ENPP2
SCHEMBL17906215 0.88 TERT (0.46) TOP1CYCSENPP2TERTABCG2
SCHEMBL17906204 0.86 MAOB (0.44) TOP1CYCSSTAT3STAT1ENPP2
SCHEMBL17904263 0.84 TERT (0.44) TOP1CYCSENPP2TERTABCG2
SCHEMBL17904268 0.81 MAOB (0.40) TOP1CYCSENPP2TERT
SCHEMBL10897459 0.81 TOP1 (0.53) TOP1CYCSENPP2ABCG2
SCHEMBL17906176 0.81 TOP1 (0.41) TOP1CYCSENPP2TERTABCG2
SCHEMBL29405434 0.81 TOP1 (0.64) TOP1CYCSSTAT3STAT1ENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10005806-B2 Metalporphyrin complex, preparation method therefor and method for preparing polycarbonate CHANGCHUN INSTITUTE OF APPLIED CHEMISTRY, CHINESE ACADEMY OF SCIENCES (CN) 2018-06-26 — — US disclosed
US-20160194346-A1 METALPORPHYRIN COMPLEX, PREPARATION METHOD THEREFOR AND METHOD FOR PREPARING POLYCARBONATE CHANGCHUN INSTITUTE OF APPLIED CHEMISTRY, CHINESE ACADEMY OF SCIENCES (CN) 2016-07-07 — — 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 (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-20160194346-A1 METALPORPHYRIN COMPLEX, PREPARATION METHOD THEREFOR AND METHOD FOR PREPARING POLYCARBONATE CYP4F11, CYP4F12, POR TOP1 3463/4885CYCS 139/4885STAT3 3172/4885
US-10005806-B2 Metalporphyrin complex, preparation method therefor and method for preparing polycarbonate CYP4F11, CYP4F12, POR TOP1 3463/4885CYCS 139/4885STAT3 3172/4885

“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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