SCHEMBL14701511

SCHEMBL14701511

COc1cccc(-c2c3nc(c(-c4cccc(C)c4)c4ccc([nH]4)c(-c4cccc(C)c4)c4nc(c(-c5cccc(OC)c5)c5ccc2[nH]5)[C@H](O)[C@@H]4O)C=C3)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 1/20 0.39
▸ PIN1 Q13526 1/20 0.38
▸ ACHE P22303 1/20 0.38
▸ TERT O14746 2/20 0.37
▸ TP53 P04637 2/20 0.37
▸ ALDH1A1 P00352 2/20 0.36
▸ HPGD P15428 2/20 0.36
▸ NPC1 O15118 2/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ HSD17B10 Q99714 2/20 0.36
▸ TDP1 Q9NUW8 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ THRB P10828 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ GLA P06280 1/20 0.36
▸ NFKB1 P19838 1/20 0.36
▸ NFKB2 Q00653 1/20 0.36
▸ RELA Q04206 1/20 0.36

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
SCHEMBL14703874 0.94 TERT (0.41) ABCG2PIN1TERTALDH1A1HPGD
SCHEMBL30081962 0.84 TERT (0.49) ABCG2TERTNPC1RAB9AMEN1
SCHEMBL433807 0.84 TERT (0.49) ABCG2TERTNPC1RAB9AMEN1
SCHEMBL14701513 0.82 ALDH1A1 (0.40) ABCG2PIN1ACHETERTALDH1A1
SCHEMBL14701515 0.81 ORAI1 (0.38) ABCG2PIN1ACHETERTTP53
SCHEMBL6514737 0.80 TERT (0.52) ABCG2TERT
SCHEMBL31456160 0.80 TERT (0.52) ABCG2TERT
SCHEMBL14701518 0.79 ABCG2 (0.36) ABCG2PIN1ACHETERTTP53
SCHEMBL12118902 0.78 TOP1 (0.42) TERT
SCHEMBL17687648 0.77 TERT (0.43) ABCG2TERTTP53NPC1RAB9A

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-9156849-B2 Application of β-functionalized dihydroxy-chlorins for PDT BIOLITEC PHARMA MARKETING LTD (MY) 2015-10-13 — — US disclosed
US-20130041307-A1 APPLICATION OF BETA-FUNCTIONALIZED DIHYDROXY-CHLORINS FOR PDT CERAMOPTEC INDUSTRIES, INC. 2013-02-14 — — 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-20130041307-A1 APPLICATION OF BETA-FUNCTIONALIZED DIHYDROXY-CHLORINS FOR PDT TK1, DHPS, DLD ABCG2 1881/4885PIN1 181/4885ACHE 4203/4885

“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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