SCHEMBL28555992

SCHEMBL28555992

Cn1nc(C(=O)O)c2ccc(C3CCCNC3)cc21

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 1/20 0.43
▸ KHK P50053 1/20 0.39
▸ HTR3A P46098 1/20 0.39

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
SCHEMBL27167661 0.75 DDB1 (0.36) KHK
SCHEMBL26636968 0.73 CRBN (0.64) —
SCHEMBL29976664 0.73 DDB1 (0.62) —
SCHEMBL26637434 0.73 CRBN (0.64) —
SCHEMBL30663133 0.73 CRBN (0.64) —
SCHEMBL27167653 0.73 DDB1 (0.62) —
SCHEMBL27168231 0.73 DDB1 (0.62) —
SCHEMBL30735429 0.73 CRBN (0.64) —
SCHEMBL26636980 0.73 CRBN (0.64) —
SCHEMBL28469672 0.71 CHRNB2 (0.39) KHK

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
CN-112673001-A Indazole carboxamides as kinase inhibitors 百时美施贵宝公司 2021-04-16 — — CN disclosed
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