SCHEMBL9481864

SCHEMBL9481864

OCCc1cc(-c2c3nc(c(-c4ccnc(CCO)c4)c4ccc([nH]4)c(-c4ccnc(CCO)c4)c4nc(c(-c5ccnc(CCO)c5)c5ccc2[nH]5)C=C4)C=C3)ccn1

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 5/20 0.52
▸ TOP1 P11387 4/20 0.45
▸ CYCS P99999 3/20 0.43
▸ ENPP2 Q13822 1/20 0.42
▸ ABCG2 Q9UNQ0 1/20 0.37

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
Hydrochloric Acid SCHEMBL9479231 0.99 TERT (0.51) TERTTOP1CYCSENPP2ABCG2
Hydrochloric Acid SCHEMBL9478984 0.99 TERT (0.51) TERTTOP1CYCSENPP2ABCG2
SCHEMBL6246614 0.89 TERT (0.51) TERTTOP1CYCSENPP2
SCHEMBL3095138 0.84 TOP1 (0.49) TERTTOP1CYCSENPP2ABCG2
Bromide SCHEMBL4135223 0.83 TOP1 (0.48) TERTTOP1CYCSENPP2ABCG2
SCHEMBL3095428 0.83 ENPP2 (0.49) TERTTOP1CYCSENPP2ABCG2
Hydrochloric Acid SCHEMBL4135149 0.83 TOP1 (0.48) TERTTOP1CYCSENPP2ABCG2
Hydrochloric Acid SCHEMBL4126385 0.82 ENPP2 (0.48) TERTTOP1CYCSENPP2ABCG2
SCHEMBL3101508 0.81 TOP1 (0.51) TERTTOP1CYCSENPP2ABCG2
Hydrochloric Acid SCHEMBL4126441 0.80 TOP1 (0.50) TERTTOP1CYCSENPP2ABCG2

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-5271764-A Ink compositions XEROX CORPORATION (US) 1993-12-21 — — US disclosed
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