SCHEMBL30452632

SCHEMBL30452632

Nc1ncc(-c2ccc3[nH]ccc3c2)nc1OCc1c(F)ccc(F)c1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 2/20 0.41
ATR Q13535 2/20 0.40
FGFR2 P21802 1/20 0.39
FLT3 P36888 1/20 0.39
LRRK2 Q5S007 5/20 0.37
MET P08581 4/20 0.37
GUSB P08236 1/20 0.36
PIK3CA P42336 1/20 0.36
FYN P06241 1/20 0.36
DYRK3 O43781 1/20 0.35
CCNT1 O60563 1/20 0.35
CCNA2 P20248 1/20 0.35
CDK2 P24941 1/20 0.35
CDK9 P50750 1/20 0.35
CDK5 Q00535 1/20 0.35
DYRK1A Q13627 1/20 0.35
CDK5R1 Q15078 1/20 0.35
DYRK2 Q92630 1/20 0.35
DYRK1B Q9Y463 1/20 0.35
MAP3K11 Q16584 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
SCHEMBL488418 1.00 CSF1R (0.41) CSF1RATRFGFR2FLT3LRRK2
SCHEMBL487614 0.84 MET (0.47) LRRK2METPIK3CADYRK1ADYRK2
SCHEMBL5484077 0.82 CSF1R (0.47) CSF1RATRMET
SCHEMBL5487393 0.81 CSF1R (0.48) CSF1RATRMET
SCHEMBL27629906 0.78 CSF1R (0.45) CSF1RMET
SCHEMBL27650112 0.78 CSF1R (0.45) CSF1RMET
SCHEMBL488920 0.78 MPO (0.44) CSF1RMET
SCHEMBL30452546 0.78 MPO (0.44) CSF1RMET
SCHEMBL488449 0.77 CSF1R (0.45) CSF1RATRMET
SCHEMBL30454721 0.77 CSF1R (0.45) CSF1RATRMET

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
CN-113181362-B Medicament for preventing and/or treating amyotrophic lateral sclerosis 国立大学法人京都大学 2023-06-13 CN disclosed