SCHEMBL12057448

SCHEMBL12057448

CCCCCCCCOc1ccc(-c2c3nc(c(-c4ccc(OCCC[N+](C)(C)C)cc4)c4ccc([nH]4)c(-c4ccc(OCCC[N+](C)(C)C)cc4)c4nc(c(-c5ccc(OCCC[N+](C)(C)C)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 2/20 0.43
▸ ENPP2 Q13822 1/20 0.41
▸ TOP1 P11387 2/20 0.40
▸ ABCG2 Q9UNQ0 1/20 0.39
▸ RARB P10826 3/20 0.39
▸ CYCS P99999 2/20 0.39
▸ NR5A1 Q13285 1/20 0.39
▸ HPGD P15428 4/20 0.38
▸ RAB9A P51151 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ LMNA P02545 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ CYP3A4 P08684 2/20 0.38
▸ CYP2D6 P10635 2/20 0.38
▸ KDM4E B2RXH2 3/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ HTT P42858 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP19A1 P11511 1/20 0.38

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
SCHEMBL12057441 1.00 TERT (0.43) TERTENPP2TOP1ABCG2RARB
SCHEMBL12057426 1.00 TERT (0.43) TERTENPP2TOP1ABCG2RARB
SCHEMBL12057400 1.00 TERT (0.43) TERTENPP2TOP1ABCG2RARB
SCHEMBL12057450 1.00 TERT (0.43) TERTENPP2TOP1ABCG2RARB
SCHEMBL12428034 1.00 TERT (0.43) TERTENPP2TOP1ABCG2RARB
SCHEMBL12057451 1.00 TERT (0.43) TERTENPP2TOP1ABCG2RARB
SCHEMBL12057440 1.00 TERT (0.43) TERTENPP2TOP1ABCG2RARB
Hydrochloric Acid SCHEMBL585082 0.99 TERT (0.44) TERTENPP2TOP1ABCG2RARB
Hydrochloric Acid SCHEMBL2197145 0.99 TERT (0.44) TERTENPP2TOP1ABCG2RARB
Hydrochloric Acid SCHEMBL2202699 0.99 TERT (0.44) TERTENPP2TOP1ABCG2RARB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8084602-B2 Porphyrin derivatives and their use in photodynamic therapy DESTINY PHARMA LIMITED (CH) 2011-12-27 — — US disclosed
US-7977474-B2 Uses of porphyrin compounds DESTINY PHARMA LTD. (GB) 2011-07-12 — — US disclosed
US-20070281915-A1 Porphyrin Derivatives and Their Use in Photodynamic Therapy DESTINY PHARMA LIMITED 2007-12-06 — — US disclosed
US-7244841-B2 Porphyrin derivatives and their use in photodynamic therapy DESTINY PHARMA LIMITED (GB) 2007-07-17 — — 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-20070281915-A1 Porphyrin Derivatives and Their Use in Photodynamic Therapy PPOX, PPIF, TYR TERT 2287/4885ENPP2 314/4885TOP1 889/4885

“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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