SCHEMBL21116409

SCHEMBL21116409

Cc1ccc(C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)cc1Nc1nccc(-c2ccc(OC(F)(F)F)cc2)n1

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BRAF P15056 2/20 0.62
MAPK14 Q16539 1/20 0.62
PDGFRA P16234 6/20 0.60
KIT P10721 5/20 0.60
KDR P35968 3/20 0.60
ABL1 P00519 12/20 0.57
RAF1 P04049 2/20 0.56
ARAF P10398 1/20 0.56
BCR P11274 5/20 0.53
PDGFRB P09619 4/20 0.53
LYN P07948 2/20 0.51
LDLR P01130 2/20 0.51
PCSK9 Q8NBP7 2/20 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
SCHEMBL19966823 0.91 BRAF (0.66) BRAFMAPK14PDGFRAKITKDR
SCHEMBL21116143 0.90 BRAF (0.65) BRAFMAPK14PDGFRAKITKDR
SCHEMBL21074053 0.90 BRAF (0.71) BRAFMAPK14PDGFRAKITKDR
SCHEMBL19966830 0.88 BRAF (0.66) BRAFMAPK14PDGFRAKITKDR
SCHEMBL19966903 0.88 BRAF (0.62) BRAFMAPK14PDGFRAKITKDR
SCHEMBL19966888 0.87 BRAF (0.64) BRAFMAPK14PDGFRAKITKDR
SCHEMBL19966831 0.86 ABL1 (0.62) PDGFRAKITKDRABL1BCR
SCHEMBL4891507 0.84 PDGFRA (0.63) PDGFRAKITKDRABL1BCR
SCHEMBL19966913 0.83 ABL1 (0.65) BRAFMAPK14PDGFRAKITKDR
SCHEMBL21074041 0.82 BRAF (0.64) BRAFMAPK14PDGFRAKITKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10793527-B2 Adenosine monophosphate-activated protein kinase agonist NATIONAL YANG-MING UNIVERSITY (TW) 2020-10-06 US disclosed
US-10793527-B2 Adenosine monophosphate-activated protein kinase agonist NATIONAL YANG-MING UNIVERSITY (TW) 2020-10-06 US disclosed
US-20190194142-A1 AN ADENOSINE MONOPHOSPHATE-ACTIVATED PROTEIN KINASE AGONIST NATIONAL YANG-MING UNIVERSITY (TW) 2019-06-27 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 (2 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-20190194142-A1 AN ADENOSINE MONOPHOSPHATE-ACTIVATED PROTEIN KINASE AGONIST PRKAG1, PRKAG2, PRKAB1 BRAF 1090/4885MAPK14 557/4885PDGFRA 844/4885
US-10793527-B2 Adenosine monophosphate-activated protein kinase agonist PRKAG1, PRKAG2, PRKAB1 BRAF 1036/4885MAPK14 565/4885PDGFRA 751/4885

“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.