SCHEMBL9970874

SCHEMBL9970874

Cc1ccc(NC(=O)c2cc(CF)cc(N3CCN(CCO)CC3)c2)cc1Nc1nn(C)cc1-c1cc(NC2CC2)ncn1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BRAF P15056 5/20 0.41
INSR P06213 3/20 0.39
LCK P06239 3/20 0.39
LYN P07948 3/20 0.39
SRC P12931 3/20 0.39
KDR P35968 3/20 0.39
ABL1 P00519 1/20 0.39
BCR P11274 1/20 0.39
MAPK14 Q16539 11/20 0.39
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
HCK P08631 2/20 0.38

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
SCHEMBL9970944 0.94 BRAF (0.47) BRAFINSRLCKLYNSRC
SCHEMBL3585148 0.91 BRAF (0.52) BRAFINSRLCKLYNSRC
SCHEMBL3589285 0.83 BRAF (0.60) BRAFINSRLCKLYNSRC
SCHEMBL3589227 0.83 BRAF (0.53) BRAFINSRLCKLYNSRC
SCHEMBL3830584 0.82 BRAF (0.55) BRAFINSRLCKLYNSRC
SCHEMBL3822904 0.81 KDR (0.52) BRAFINSRLCKLYNSRC
SCHEMBL9967392 0.78 KDR (0.47) BRAFINSRLCKLYNSRC
SCHEMBL13891376 0.77 BRAF (0.44) BRAFLCKLYNSRCKDR
SCHEMBL13301710 0.76 HCK (0.51) BRAFINSRLCKLYNSRC
SCHEMBL3589391 0.76 KDR (0.59) BRAFINSRLCKLYNSRC

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-8202876-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2012-06-19 US disclosed
US-20100029605-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2010-02-04 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-20100029605-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS FYN, ABL2, LCK BRAF 11/4885INSR 931/4885LCK 3/4885

“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.