SCHEMBL25432829

SCHEMBL25432829

CC(=O)c1c(C2CC2)c2cc(Cl)ccc2[nH]c1=O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 2/20 0.48
CYP1A2 P05177 2/20 0.48
MEN1 O00255 1/20 0.48
ALDH1A1 P00352 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
KMT2A Q03164 1/20 0.48
GSK3B P49841 1/20 0.43
MAP2 P11137 1/20 0.43
GRIN2D O15399 2/20 0.43
GRIN3B O60391 2/20 0.43
GRIN1 Q05586 2/20 0.43
GRIN2A Q12879 2/20 0.43
GRIN2B Q13224 2/20 0.43
GRIN2C Q14957 2/20 0.43
GRIN3A Q8TCU5 2/20 0.43
LMNA P02545 1/20 0.42
KDM4E B2RXH2 2/20 0.42
SIRT1 Q96EB6 1/20 0.41
PTGS2 P35354 1/20 0.41

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
SCHEMBL30590427 1.00 CSF1R (0.48) CSF1RCYP1A2MEN1ALDH1A1CYP3A4
SCHEMBL30044896 0.80 CSF1R (0.49) CSF1RCYP1A2GSK3BMAP2GRIN2D
SCHEMBL23498272 0.80 CSF1R (0.49) CSF1RCYP1A2GSK3BMAP2GRIN2D
SCHEMBL31139832 0.79 SIRT1 (0.52) CSF1RCYP1A2GSK3BMAP2GRIN2D
SCHEMBL25430492 0.79 SIRT1 (0.52) CSF1RCYP1A2GSK3BMAP2GRIN2D
SCHEMBL23510959 0.79 GRIN2D (0.58) CSF1RCYP1A2MEN1ALDH1A1CYP3A4
SCHEMBL25432139 0.77 PADI4 (0.56) ALDH1A1LMNA
SCHEMBL25432141 0.77 PADI4 (0.56) ALDH1A1LMNA
SCHEMBL30043560 0.74 MAP2 (0.74) CSF1RCYP1A2ALDH1A1GSK3BMAP2
SCHEMBL6059495 0.74 MAP2 (0.74) CSF1RCYP1A2ALDH1A1GSK3BMAP2

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-2023161782-A1 NOVEL BICYCLIC COMPOUNDS AS RAD51 INHIBITORS SATYARX PHARMA INNOVATIONS PVT LTD (IN) 2023-08-31 WO disclosed