SCHEMBL24316983

SCHEMBL24316983

COc1cc(Oc2ccc3ncc(C)c(=O)n3c2)cnc1OCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 2/20 0.46
PIK3CA P42336 4/20 0.38
MTOR P42345 3/20 0.38
PDGFRB P09619 1/20 0.38
PDGFRA P16234 1/20 0.38
TLR8 Q9NR97 1/20 0.38
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
GRM5 P41594 1/20 0.36
MCHR1 Q99705 1/20 0.36
GABRA1 P14867 1/20 0.35
GABRG2 P18507 1/20 0.35
GABRB3 P28472 1/20 0.35
GABRA5 P31644 1/20 0.35
GABRA3 P34903 1/20 0.35
GABRA2 P47869 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
PDE2A O00408 1/20 0.35

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
SCHEMBL24316434 0.93 CSF1R (0.53) CSF1RPIK3CAMTORALDH1A1GRM5
SCHEMBL24316982 0.92 CSF1R (0.48) CSF1RPIK3CAMTORALDH1A1GRM5
SCHEMBL24316814 0.91 CSF1R (0.47) CSF1RPIK3CAMTORALDH1A1GRM5
SCHEMBL24316622 0.91 CYP11B1 (0.39) CSF1RPIK3CAMTORMCHR1RXFP1
SCHEMBL24316551 0.90 GRM5 (0.49) CSF1RGRM5ALKBH1
SCHEMBL24316448 0.89 CSF1R (0.45) CSF1RPIK3CAMTORGRM5MCHR1
SCHEMBL24316437 0.88 CSF1R (0.45) CSF1RPIK3CAMTORGRM5RXFP1
SCHEMBL24316587 0.87 CSF1R (0.44) CSF1RPIK3CAMTORMCHR1RXFP1
SCHEMBL24316553 0.87 CSF1R (0.46) CSF1RPIK3CAMTORRXFP1ALKBH1
SCHEMBL24316621 0.86 PIK3CA (0.38) CSF1RPIK3CAMTORALDH1A1LMNA

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-2022057895-A1 HETEROAROMATIC COMPOUNDS AND USES THEREOF HUTCHISON MEDIPHARMA LIMITED (CN) 2022-03-24 WO disclosed