SCHEMBL28786384

SCHEMBL28786384

CCCC[Sn](CCCC)(CCCC)c1nccnc1C#N

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
MAPK1 P28482 1/20 0.33

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
SCHEMBL5280126 0.76 HPGD (0.46) ALDH1A1
SCHEMBL23162812 0.74 ALDH1A1 (0.32) ALDH1A1
SCHEMBL114947 0.73
SCHEMBL23162814 0.73
SCHEMBL27964368 0.71 ALDH1A1 (0.44) ALDH1A1MAPK1
SCHEMBL2213452 0.70 CYP3A4 (0.33)
SCHEMBL1033248 0.69 ALDH1A1 (0.40) ALDH1A1MAPK1
SCHEMBL28786396 0.69 LMNA (0.36)
SCHEMBL29785681 0.69 LMNA (0.36)
SCHEMBL109668 0.67 CYP2D6 (0.34) ALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4065230-A1 THERAPEUTIC COMPOUNDS Genentech, Inc. (US) 2022-10-05 EP disclosed
CN-114786778-A Therapeutic compounds 基因泰克公司 2022-07-22 CN disclosed