SCHEMBL281869

SCHEMBL281869

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

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BRAF P15056 11/20 0.63
KDR P35968 8/20 0.63
RAF1 P04049 7/20 0.63
PDGFRB P09619 1/20 0.61
KIT P10721 1/20 0.61
PDGFRA P16234 1/20 0.61
FGFR2 P21802 1/20 0.61
FLT3 P36888 1/20 0.61
CDK8 P49336 2/20 0.61

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) BRAFKDRRAF1PDGFRBKIT
SCHEMBL282287 0.89 RAF1 (0.56) BRAFKDRRAF1PDGFRBKIT
SCHEMBL938819 0.81 KDR (0.70) BRAFKDRRAF1PDGFRBKIT
SCHEMBL10073788 0.80 KDR (0.59) BRAFKDRRAF1PDGFRBKIT
SCHEMBL5899269 0.80 CDK8 (0.74) BRAFKDRRAF1PDGFRBKIT
SCHEMBL12319881 0.80 KDR (0.76) BRAFKDRRAF1PDGFRBKIT
SCHEMBL16621285 0.79 RAF1 (0.69) BRAFKDRRAF1PDGFRBKIT
SCHEMBL30462521 0.78 RAF1 (0.73) BRAFKDRRAF1PDGFRBKIT
SCHEMBL936533 0.78 RAF1 (0.73) BRAFKDRRAF1PDGFRBKIT
SCHEMBL21750962 0.78 KDR (1.00) BRAFKDRRAF1

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 BRAF 1216/4885KDR 3633/4885RAF1 955/4885

“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.