SCHEMBL25756891

SCHEMBL25756891

Cc1cnn2c(C#Cc3cc(C(N)=O)ccc3C)cnc2c1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 2/20 0.49
ROR1 Q01973 5/20 0.48
ABL1 P00519 11/20 0.47
KIT P10721 2/20 0.41
DDR1 Q08345 2/20 0.41
DDR2 Q16832 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
SCHEMBL22243490 0.85 CSF1R (0.66) CSF1RROR1ABL1
SCHEMBL29493472 0.85 CSF1R (0.66) CSF1RROR1ABL1
Hydrochloric Acid SCHEMBL29493480 0.76 ABL1 (0.51) CSF1RROR1ABL1DDR1DDR2
SCHEMBL15096062 0.75 ROR1 (0.67) CSF1RROR1ABL1KITDDR1
SCHEMBL29506341 0.75 CSF1R (0.67) CSF1RROR1ABL1
SCHEMBL24925257 0.74 CSF1R (0.51) CSF1RROR1ABL1KITDDR1
SCHEMBL24538368 0.73 ABL1 (0.53) CSF1RROR1ABL1
SCHEMBL16620724 0.73 MKNK1 (0.56) ABL1
SCHEMBL30010219 0.73 CSF1R (0.72) CSF1RROR1ABL1
SCHEMBL12652639 0.73 CSF1R (0.72) CSF1RROR1ABL1

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-2023119334-A1 ANTI-CANCER COMPOUND BY COMBINING PONATINIB MOLECULE WITH HDAC INHIBITOR MOLECULE USING A VARIABLE LENGTH LINKER AMRITA VISHWA VIDYAPEETHAM (IN) 2023-06-29 WO disclosed