SCHEMBL15088585

SCHEMBL15088585

C=CC(=O)c1ccc(C)c(C#Cc2cnc3cccnn23)c1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 1/20 0.62
ROR1 Q01973 6/20 0.61
ABL1 P00519 12/20 0.60
KCNH2 Q12809 2/20 0.51
FGFR1 P11362 1/20 0.51
FGFR2 P21802 1/20 0.51
FGFR4 P22455 1/20 0.51
FGFR3 P22607 1/20 0.51
CYP3A4 P08684 1/20 0.51

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
SCHEMBL15096062 0.87 ROR1 (0.67) CSF1RROR1ABL1KCNH2FGFR1
SCHEMBL589881 0.87 CSF1R (0.67) CSF1RROR1ABL1KCNH2CYP3A4
SCHEMBL29506341 0.87 CSF1R (0.67) CSF1RROR1ABL1KCNH2CYP3A4
SCHEMBL12652759 0.86 CSF1R (0.66) CSF1RROR1ABL1KCNH2CYP3A4
SCHEMBL22243490 0.86 CSF1R (0.66) CSF1RROR1ABL1KCNH2CYP3A4
SCHEMBL29493472 0.86 CSF1R (0.66) CSF1RROR1ABL1KCNH2CYP3A4
SCHEMBL22580709 0.85 CSF1R (0.61) CSF1RROR1ABL1KCNH2FGFR1
SCHEMBL30010219 0.84 CSF1R (0.72) CSF1RROR1ABL1KCNH2CYP3A4
SCHEMBL19317721 0.81 ROR1 (0.79) CSF1RROR1ABL1KCNH2CYP3A4
SCHEMBL24123162 0.80 ABL1 (0.66) CSF1RROR1ABL1KCNH2FGFR1

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-2013101281-A1 METHODS AND COMPOSITIONS FOR TREATING PARKINSON'S DISEASE ARIAD PHARMACEUTICALS, INC. (US) 2013-07-04 WO disclosed