SCHEMBL31403695

SCHEMBL31403695

CN1CCC(n2ccc3cc(C(=O)O)cnc32)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM2B Q8NHM5 2/20 0.46
AURKA O14965 3/20 0.43
HTR1A P08908 2/20 0.43
HTR1B P28222 2/20 0.43
HTR1F P30939 2/20 0.43
HTR1D P28221 1/20 0.43
CDK1 P06493 2/20 0.41
AURKB Q96GD4 1/20 0.41
SCD O00767 1/20 0.41
INSR P06213 1/20 0.38
PDGFRB P09619 1/20 0.38
CDK4 P11802 1/20 0.38
SRC P12931 1/20 0.38
PDGFRA P16234 1/20 0.38
FLT1 P17948 1/20 0.38
FLT4 P35916 1/20 0.38
KDR P35968 1/20 0.38
CDK7 P50613 1/20 0.38
NTRK2 Q16620 1/20 0.38
MGAM O43451 1/20 0.38

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
SCHEMBL31403604 0.90 AURKA (0.48) AURKASCDCDK4MGAMHSD17B10
SCHEMBL31403701 0.87 AURKA (0.52) AURKACDK1AURKBSCDCDK4
SCHEMBL31403618 0.87 HTR1A (0.43) KDM2BAURKAHTR1AHTR1BHTR1F
SCHEMBL31403655 0.84 AURKA (0.44) AURKACDK4MGAMHSD17B10GAA
SCHEMBL31403478 0.82 GPR119 (0.46) AURKBSRC
SCHEMBL31403738 0.81 DGAT1 (0.44) AURKAMGAMHSD17B10GAADGAT1
SCHEMBL21671863 0.79 DGAT1 (0.41) AURKAHTR1AHTR1BHTR1FHTR1D
SCHEMBL4228613 0.78 HTR1A (0.53) KDM2BHTR1AHTR1BHTR1FHTR1D
SCHEMBL31403633 0.77 PSMD14 (0.43) AURKACDK4HSD17B10GAAHPGD
SCHEMBL13841049 0.75 HTR1A (0.61) KDM2BHTR1AHTR1BHTR1FHTR1D

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-2025076284-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USING THE SAME DELPHIA THERAPEUTICS, INC. (US) 2025-04-10 WO disclosed