SCHEMBL15469397

SCHEMBL15469397

Cc1ccc(-n2nc(C(C)(F)F)cc2NC(=O)Oc2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 13/20 0.58
MAPK13 O15264 11/20 0.58
MAPK12 P53778 10/20 0.58
MAPK11 Q15759 10/20 0.58
CDK8 P49336 2/20 0.55
DDR2 Q16832 1/20 0.50
PTK2 Q05397 2/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C9 P11712 1/20 0.49
JAK2 O60674 1/20 0.49
CCNC P24863 1/20 0.48

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
SCHEMBL1013047 0.93 MAPK13 (0.54) MAPK14MAPK13MAPK12MAPK11JAK2
SCHEMBL1013230 0.92 MAPK14 (0.56) MAPK14MAPK13MAPK12MAPK11CDK8
SCHEMBL378957 0.92 MAPK14 (0.68) MAPK14MAPK13MAPK12MAPK11CDK8
SCHEMBL15492471 0.92 MAPK14 (0.56) MAPK14MAPK13MAPK12MAPK11CDK8
SCHEMBL1783390 0.90 MAPK14 (0.61) MAPK14MAPK13MAPK12MAPK11JAK2
SCHEMBL15492491 0.89 MAPK14 (0.58) MAPK14MAPK13MAPK12MAPK11CDK8
SCHEMBL1064616 0.88 MAPK13 (0.56) MAPK14MAPK13MAPK12MAPK11CDK8
SCHEMBL17920842 0.88 BRAF (0.45) MAPK14MAPK13MAPK12MAPK11CDK8
SCHEMBL15492502 0.86 MAPK14 (0.55) MAPK14MAPK13MAPK12MAPK11CDK8
SCHEMBL1012616 0.86 MAPK13 (0.66) MAPK14MAPK13MAPK12MAPK11JAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170298029-A1 RAF KINASE MODULATOR COMPOUNDS AND METHODS OF USE THEREOF AMBIT BIOSCIENCES CORPORATION (US) 2017-10-19 US disclosed
US-9730937-B2 RAF kinase modulator compounds and methods of use thereof AMBIT BIOSCIENCES CORPORATION (US) 2017-08-15 US disclosed
US-20160199375-A1 RAF KINASE MODULATOR COMPOUNDS AND METHODS OF USE THEREOF AMBIT BIOSCIENCES CORP. 2016-07-14 US disclosed
US-9320739-B2 RAF kinase modulator compounds and methods of use thereof AMBIT BIOSCIENCES CORPORATION (US) 2016-04-26 US disclosed
US-20150246042-A1 RAF KINASE MODULATOR COMPOUNDS AND METHODS OF USE THEREOF AMBIT BIOSCIENCES CORPORATION (US) 2015-09-03 US disclosed
US-8969587-B2 RAF kinase modulator compounds and methods of use thereof AMBIT BIOSCIENCES CORPORATION (US) 2015-03-03 US disclosed
US-20140045868-A1 RAF KINASE MODULATOR COMPOUNDS AND METHODS OF USE THEREOF AMBIT BIOSCIENCES CORPORATION (US) 2014-02-13 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 (4 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-20160199375-A1 RAF KINASE MODULATOR COMPOUNDS AND METHODS OF USE THEREOF BRAF, RAF1, ARAF MAPK14 145/4885MAPK13 117/4885MAPK12 139/4885
US-20170298029-A1 RAF KINASE MODULATOR COMPOUNDS AND METHODS OF USE THEREOF BRAF, RAF1, ARAF MAPK14 145/4885MAPK13 117/4885MAPK12 139/4885
US-20150246042-A1 RAF KINASE MODULATOR COMPOUNDS AND METHODS OF USE THEREOF BRAF, RAF1, ARAF MAPK14 145/4885MAPK13 117/4885MAPK12 139/4885
US-20140045868-A1 RAF KINASE MODULATOR COMPOUNDS AND METHODS OF USE THEREOF BRAF, RAF1, ARAF MAPK14 145/4885MAPK13 117/4885MAPK12 139/4885

“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.