SCHEMBL24587302

SCHEMBL24587302

CCNc1ncc(C2CC2)cc1SC

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.34
IGF1R P08069 1/20 0.33
PGK1 P00558 1/20 0.32
DHODH Q02127 1/20 0.32
FPR2 P25090 1/20 0.32
KDM4E B2RXH2 1/20 0.31
PDGFRB P09619 1/20 0.30
PDGFRA P16234 1/20 0.30

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
SCHEMBL24587301 0.72 KDM4E (0.35) FPR2KDM4EPDGFRBPDGFRA
SCHEMBL24588293 0.72 PGK1 (0.40) PDE10APGK1
SCHEMBL24588281 0.72 PGK1 (0.31) PGK1
SCHEMBL22272004 0.69 KDM4E (0.33) FPR2KDM4EPDGFRBPDGFRA
SCHEMBL17504803 0.67 SMN1; SMN2 (0.36) KDM4EPDGFRBPDGFRA
SCHEMBL20848120 0.67 KDM4E (0.33) FPR2KDM4EPDGFRBPDGFRA
SCHEMBL19453382 0.66 KDM4E (0.35) KDM4EPDGFRBPDGFRA
SCHEMBL20848148 0.66 ALDH1A1 (0.36) KDM4E
SCHEMBL32678469 0.66 ALDH1A1 (0.36) KDM4E
SCHEMBL32678467 0.66 ALDH1A1 (0.36) KDM4E

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-2022135430-A1 HETEROARYL COMPOUNDS, PREPARATION METHODS AND USES THEREOF InventisBio Co., Ltd. (CN) 2022-06-30 WO disclosed