SCHEMBL28048124

SCHEMBL28048124

Brc1cc2c(s1)CCOC2

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 1/20 0.42
PNMT P11086 2/20 0.40
GRIN2B Q13224 2/20 0.32
PDK1 Q15118 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
SCHEMBL16416203 0.81
SCHEMBL18723671 0.78 FBP1 (0.35) FBP1PDK1
SCHEMBL16809691 0.76 FBP1 (0.34) FBP1PDK1
SCHEMBL16327923 0.76 PNMT (0.52) FBP1PNMTPDK1
SCHEMBL24342158 0.76 FBP1 (0.34) FBP1PDK1
SCHEMBL31035824 0.73 GRIN2B (0.37) FBP1GRIN2B
SCHEMBL18197636 0.73 KCNH2 (0.35) FBP1PNMT
SCHEMBL2928944 0.72 FBP1 (0.35) FBP1
SCHEMBL16854836 0.72 PRKDC (0.36) FBP1
SCHEMBL13424010 0.72 PRKDC (0.36) FBP1

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
CN-119954831-A Pyrimidopyrazoles, preparation method and medical application thereof 江苏恒瑞医药股份有限公司 2025-05-09 CN disclosed
CN-102731574-B Thienopyridines α-amido benzyl phosphonic acid ester, Preparation Method And The Use Institute of Toxicology and Drugs, Chinese Academy of Military Medical Sciences (CN) 2016-03-02 CN disclosed