SCHEMBL26944060

SCHEMBL26944060

Bc1cc(C2CCC(CO)O2)n2ncnc(N)c12

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ACVRL1 P37023 16/20 0.43
▸ PIK3CD O00329 2/20 0.36
▸ TNK2 Q07912 1/20 0.36
▸ CYP2A6 P11509 1/20 0.34

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
SCHEMBL7605058 0.86 ACVRL1 (0.44) ACVRL1PIK3CD
SCHEMBL14642544 0.86 ACVRL1 (0.41) ACVRL1PIK3CDTNK2CYP2A6
SCHEMBL7602181 0.83 PIK3CD (0.42) ACVRL1PIK3CD
SCHEMBL7605044 0.83 ACVRL1 (0.39) ACVRL1PIK3CDTNK2CYP2A6
SCHEMBL10105828 0.83 ACVRL1 (0.39) ACVRL1PIK3CDTNK2
SCHEMBL10105829 0.83 ACVRL1 (0.39) ACVRL1PIK3CD
SCHEMBL24606324 0.82 ACVRL1 (0.34) ACVRL1PIK3CDTNK2
SCHEMBL26026926 0.82 ACVRL1 (0.34) ACVRL1PIK3CDTNK2
SCHEMBL7602863 0.80 ACVRL1 (0.43) ACVRL1PIK3CD
SCHEMBL14642736 0.79 ACVRL1 (0.45) ACVRL1PIK3CD

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
WO-2023239665-A1 METHODS FOR TREATMENT OF VIRAL INFECTIONS INCLUDING SARS-COV-2 GILEAD SCIENCES, INC. (US) 2023-12-14 — — WO disclosed
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