SCHEMBL2679876

SCHEMBL2679876

Cc1ccc(C(=O)Nc2ccc(C)c(C(F)(F)F)c2)cc1NC(=O)C=Cc1cncnc1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KIT P10721 6/20 0.56
LCK P06239 3/20 0.56
SRC P12931 3/20 0.56
MAPK14 Q16539 3/20 0.56
BRAF P15056 9/20 0.55
EGFR P00533 4/20 0.55
CSF1R P07333 4/20 0.50
DDR1 Q08345 1/20 0.49
DDR2 Q16832 1/20 0.49
CDK8 P49336 1/20 0.47
KDR P35968 2/20 0.47
PDGFRA P16234 1/20 0.47
ABL1 P00519 2/20 0.47
RAF1 P04049 1/20 0.46
ARAF P10398 1/20 0.46

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
SCHEMBL2679325 0.96 BRAF (0.56) KITLCKSRCMAPK14BRAF
SCHEMBL10054826 0.96 BRAF (0.56) KITLCKSRCMAPK14BRAF
SCHEMBL10077224 0.94 KIT (0.53) KITLCKSRCMAPK14BRAF
SCHEMBL2679875 0.94 KIT (0.53) KITLCKSRCMAPK14BRAF
SCHEMBL10078411 0.94 BRAF (0.55) KITLCKSRCMAPK14BRAF
SCHEMBL2679066 0.94 BRAF (0.55) KITLCKSRCMAPK14BRAF
SCHEMBL2679206 0.90 CSF1R (0.57) KITBRAFEGFRCSF1RDDR1
SCHEMBL10077755 0.90 CSF1R (0.57) KITBRAFEGFRCSF1RDDR1
SCHEMBL2679307 0.88 KIT (0.62) KITLCKSRCMAPK14BRAF
SCHEMBL2679346 0.88 KIT (0.51) KITLCKSRCMAPK14BRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8426446-B2 Acrylamide derivative and use thereof in manufacture of medicament BEIJING SHIQIAO BIOPHARM CO. LTD. (CN) 2013-04-23 US claimed
US-20120116075-A1 Acrylamide Derivative And Use Thereof In Manufacture Of Medicament BEIJING JIASHILIANBO PHARM SCI & TECH CO. LTD 2012-05-10 US claimed
US-8426446-B2 Acrylamide derivative and use thereof in manufacture of medicament BEIJING SHIQIAO BIOPHARM CO. LTD. (CN) 2013-04-23 US disclosed
US-20120116075-A1 Acrylamide Derivative And Use Thereof In Manufacture Of Medicament BEIJING JIASHILIANBO PHARM SCI & TECH CO. LTD 2012-05-10 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-20120116075-A1 Acrylamide Derivative And Use Thereof In Manufacture Of Medicament ABL1, ABL2, BCR KIT 399/4885LCK 14/4885SRC 8/4885

“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.