SCHEMBL282287

SCHEMBL282287

COc1ncncc1Oc1ccc(NC(=O)Nc2ccc(Br)c(C(F)(F)F)c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 8/20 0.56
KDR P35968 9/20 0.50
BRAF P15056 8/20 0.50
CDK8 P49336 3/20 0.49
PDGFRB P09619 1/20 0.48
KIT P10721 1/20 0.48
PDGFRA P16234 1/20 0.48
FGFR2 P21802 1/20 0.48
FLT3 P36888 1/20 0.48
MAPK14 Q16539 3/20 0.47
TNNI3K Q59H18 3/20 0.47

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
SCHEMBL282376 0.90 CDK8 (0.61) RAF1KDRBRAFCDK8PDGFRB
SCHEMBL281869 0.89 BRAF (0.63) RAF1KDRBRAFCDK8PDGFRB
SCHEMBL10073788 0.80 KDR (0.59) RAF1KDRBRAFPDGFRBKIT
SCHEMBL3181311 0.78 RAF1 (0.70) RAF1KDRBRAFCDK8PDGFRB
SCHEMBL282138 0.77 KDR (0.61) RAF1KDRBRAFPDGFRAMAPK14
SCHEMBL281954 0.77 CSF1R (0.70) RAF1KDRBRAFPDGFRBKIT
SCHEMBL282288 0.76 RAF1 (0.64) RAF1KDRBRAFCDK8PDGFRB
SCHEMBL281698 0.76 RAF1 (0.50) RAF1KDRBRAFCDK8PDGFRB
SCHEMBL4931395 0.75 KDR (0.60) RAF1KDRBRAFCDK8PDGFRB
SCHEMBL4933039 0.74 KDR (0.71) RAF1KDRBRAFCDK8PDGFRB

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
EP-2428506-B1 HETEROCYCLIC SUBSTITUTED ACARDITE DERIVATES AND USE THEREOF NANJING LUYESIKE PHARMACEUTICAL CO LTD (CN) 2014-03-05 EP disclosed
EP-2428506-A1 HETEROCYCLIC SUBSTITUTED ACARDITE DERIVATES AND USE THEREOF Jiangsu Provincial Institute Of Materia Medica Co. (CN) 2012-03-14 EP disclosed
US-20120053192-A1 Heterocyclic Substituted Acardite Derivate and Application Thereof NANJING LUYESIKE PHARMACEUTICAL CO., LTD. (CN) 2012-03-01 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-20120053192-A1 Heterocyclic Substituted Acardite Derivate and Application Thereof H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, IDH1, CA7 RAF1 955/4885KDR 3633/4885BRAF 1216/4885

“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.