SCHEMBL15069877

SCHEMBL15069877

CC#Cc1c2cc3cc(C)sc3cc2c(C#CC)c2cc3cc(C)sc3cc12

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.31

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
SCHEMBL10045627 0.92 ALDH1A1 (0.37) ALDH1A1
SCHEMBL15069876 0.80 — —
SCHEMBL15069879 0.80 — —
SCHEMBL15069875 0.80 — —
SCHEMBL18643478 0.77 — —
SCHEMBL18267816 0.77 — —
SCHEMBL15069905 0.76 — —
SCHEMBL2603156 0.76 ALDH1A1 (0.36) ALDH1A1
SCHEMBL18352051 0.74 ALDH1A1 (0.35) ALDH1A1
SCHEMBL12397408 0.74 APP (0.32) —

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-20130161568-A1 Anthra[2,3-b:7,6-b']dithiophene Derivatives and their Use as Organic Semiconductors MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-06-27 — — US disclosed
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