SCHEMBL24316660

SCHEMBL24316660

COc1ccc(COc2ncc(Oc3ccc4ncc(C)c(=O)n4c3)cc2C#N)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 2/20 0.40
CNR1 P21554 1/20 0.36
FLT3 P36888 1/20 0.36
PIK3CA P42336 1/20 0.35
MTOR P42345 1/20 0.35
ALKBH1 Q13686 1/20 0.35
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
GRM5 P41594 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
PKM P14618 1/20 0.34
HPGD P15428 1/20 0.34
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
NPBWR1 P48145 1/20 0.33

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
SCHEMBL24316545 0.89 CSF1R (0.43) CSF1RPIK3CAMTORALKBH1KDM4E
SCHEMBL24316434 0.87 CSF1R (0.53) CSF1RPIK3CAMTORALKBH1KDM4E
SCHEMBL24316565 0.86 CSF1R (0.44) CSF1RPIK3CAMTORALKBH1KDM4E
SCHEMBL24316658 0.82 CSF1R (0.42) CSF1RALKBH1KDM4EALDH1A1GRM5
SCHEMBL24316982 0.82 CSF1R (0.48) CSF1RPIK3CAMTORALKBH1KDM4E
SCHEMBL24316659 0.81 ALKBH1 (0.40) CSF1RALKBH1KDM4EALDH1A1GRM5
SCHEMBL24316554 0.81 CSF1R (0.42) CSF1RPIK3CAMTOR
SCHEMBL24316814 0.81 CSF1R (0.47) CSF1RPIK3CAMTORKDM4EALDH1A1
SCHEMBL24316428 0.81 ALKBH1 (0.39) CSF1RALKBH1KDM4EALDH1A1GRM5
SCHEMBL24316983 0.80 CSF1R (0.46) CSF1RPIK3CAMTORALKBH1ALDH1A1

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