SCHEMBL15085693

SCHEMBL15085693

FC(F)(F)c1ccc(-c2c3nc(c(-c4ccc(C(F)(F)F)cc4)c4ccc([nH]4)c(-c4ccc(C(F)(F)F)cc4)c4nc(c(-c5ccc(C(F)(F)F)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 4/20 0.56
▸ CYCS P99999 3/20 0.54
▸ TERT O14746 3/20 0.53
▸ ENPP2 Q13822 1/20 0.53
▸ ABCG2 Q9UNQ0 1/20 0.46

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 SCHEMBL31547368 0.97 TOP1 (0.57) TOP1CYCSTERTENPP2ABCG2
SCHEMBL16921240 0.92 TOP1 (0.50) TOP1CYCSTERTENPP2ABCG2
SCHEMBL16604343 0.91 TOP1 (0.51) TOP1CYCSTERTENPP2
SCHEMBL5015413 0.87 TOP1 (0.46) TOP1CYCSTERTENPP2ABCG2
SCHEMBL10589720 0.85 TERT (0.47) TOP1CYCSTERTENPP2
SCHEMBL30774963 0.83 TERT (0.57) TOP1CYCSTERTENPP2ABCG2
SCHEMBL1971674 0.83 TERT (0.57) TOP1CYCSTERTENPP2ABCG2
SCHEMBL27949267 0.81 TERT (0.55) TOP1CYCSTERTENPP2ABCG2
SCHEMBL8908238 0.81 TERT (0.46) TOP1CYCSTERT
SCHEMBL30092778 0.80 TOP1 (0.60) TOP1CYCSTERTENPP2ABCG2

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
WO-2023174983-A1 PROCESS GIVAUDAN SA (CH) 2023-09-21 — — WO disclosed
US-9376413-B1 Succinic anhydrides from epoxides CORNELL UNIVERSITY (US) 2016-06-28 — — US disclosed
US-8921581-B1 Succinic anhydrides from epoxides CORNELL RESEARCH FOUNDATION, INC. (US) 2014-12-30 — — US disclosed
US-8481756-B1 Succinic anhydrides from epoxides CORNELL RESEARCH FOUNDATION, INC. (US) 2013-07-09 — — US disclosed
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