SCHEMBL29022339

SCHEMBL29022339

O=c1[nH]nc(C2COCCN2)o1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 11/20 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
SCHEMBL29022336 1.00 NOTUM (0.33) NOTUM
Hydrochloric Acid SCHEMBL29962930 0.98 NOTUM (0.33) NOTUM
SCHEMBL24716671 0.68 CYP1A2 (0.32)
SCHEMBL15924183 0.68 CYP1A2 (0.32)
SCHEMBL15924181 0.68 CYP1A2 (0.32)
SCHEMBL27938592 0.68 PRKACA (0.34)
SCHEMBL29022340 0.67 BAZ2A (0.30)
SCHEMBL29022342 0.67 BAZ2A (0.30)
Hydrochloric Acid SCHEMBL15923605 0.67 CYP1A2 (0.33)
Hydrochloric Acid SCHEMBL15923608 0.67 CYP1A2 (0.33)

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-107793409-B Dihydropyrimidine compound and application thereof in medicine 广东东阳光药业有限公司 2022-09-27 CN disclosed