SCHEMBL18016751

SCHEMBL18016751

COc1cc(Oc2ccc(-c3nnc(Nc4cccc(CF)c4)[nH]3)cc2)nc(N)n1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 2/20 0.37
KIT P10721 1/20 0.37
PDGFRA P16234 1/20 0.37
CDK11B P21127 1/20 0.37
FLT3 P36888 1/20 0.37
CDKL2 Q92772 1/20 0.37
KDR P35968 3/20 0.35
MAPK14 Q16539 1/20 0.35
TNNI3K Q59H18 1/20 0.35
RAB9A P51151 4/20 0.34
NPC1 O15118 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
EGFR P00533 2/20 0.34
FLT1 P17948 1/20 0.34
ACP1 P24666 6/20 0.33
ALDH1A1 P00352 2/20 0.32
POLB P06746 1/20 0.32
NUDT1 P36639 1/20 0.32
CDK5 Q00535 1/20 0.32
TEK Q02763 1/20 0.31

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
SCHEMBL14949394 0.92 RAB9A (0.41) PDGFRBKITPDGFRACDK11BFLT3
SCHEMBL14949504 0.91 KDR (0.38) PDGFRBKITPDGFRACDK11BFLT3
SCHEMBL14949279 0.87 PDGFRB (0.37) PDGFRBKITPDGFRACDK11BFLT3
SCHEMBL625593 0.85 PDGFRB (0.51) PDGFRBKITPDGFRACDK11BFLT3
SCHEMBL16330585 0.82 CDK2 (0.34) PDGFRBKITPDGFRACDK11BFLT3
SCHEMBL17658736 0.80 PDGFRB (0.49) PDGFRBKITPDGFRACDK11BFLT3
SCHEMBL14949247 0.79 RAB9A (0.37) PDGFRBKITPDGFRACDK11BFLT3
SCHEMBL14949260 0.79 KIT (0.37) PDGFRBKITPDGFRACDK11BFLT3
SCHEMBL12348791 0.79 KDR (0.45) PDGFRBKITPDGFRACDK11BFLT3
SCHEMBL12336276 0.78 PDGFRB (0.49) PDGFRBKITPDGFRACDK11BFLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160237064-A1 THERAPEUTIC METHODS AND COMPOSITIONS INVOLVING ALLOSTERIC KINASE INHIBITION AMITECH THERAPEUTIC SOLUTIONS, INC. 2016-08-18 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-20160237064-A1 THERAPEUTIC METHODS AND COMPOSITIONS INVOLVING ALLOSTERIC KINASE INHIBITION TIE1, PRKCH, PACSIN2 PDGFRB 486/4885KIT 799/4885PDGFRA 644/4885

“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.