SCHEMBL16640183

SCHEMBL16640183

Cc1ccc(NC(=O)c2ccc3ccn(C)c3c2)cc1C#Cc1cnc2cccnn12

nearest known ligand 0.94

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ROR1 Q01973 13/20 0.94
CSF1R P07333 1/20 0.65
ABL1 P00519 6/20 0.65
ABL2 P42684 1/20 0.60

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
SCHEMBL30987917 0.97 ROR1 (1.00) ROR1CSF1RABL1
SCHEMBL30987894 0.86 ROR1 (0.81) ROR1CSF1RABL1ABL2
SCHEMBL30987915 0.84 ROR1 (0.75) ROR1CSF1RABL1ABL2
SCHEMBL19317721 0.82 ROR1 (0.79) ROR1CSF1RABL1
SCHEMBL16644466 0.82 CSF1R (0.75) ROR1CSF1RABL1
SCHEMBL16250614 0.81 ABL1 (0.80) ROR1CSF1RABL1ABL2
SCHEMBL30987922 0.80 ROR1 (0.69) ROR1CSF1RABL1ABL2
SCHEMBL12682241 0.80 ROR1 (0.72) ROR1CSF1RABL1ABL2
SCHEMBL30987865 0.80 ROR1 (0.86) ROR1CSF1RABL1
SCHEMBL16644461 0.80 ABL1 (0.84) ROR1CSF1RABL1ABL2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150105377-A1 Methods and Compositions for RAF Kinase Mediated Diseases ARIAD PHARMACEUTICALS, INC. 2015-04-16 US disclosed
US-20150105377-A1 Methods and Compositions for RAF Kinase Mediated Diseases ARIAD PHARMACEUTICALS, INC. 2015-04-16 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150105377-A1 Methods and Compositions for RAF Kinase Mediated Diseases BRAF, RAF1, NRAS ROR1 263/4885CSF1R 2599/4885ABL1 75/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.