SCHEMBL22972197

SCHEMBL22972197

Cc1c(Oc2ccnc3cc(OC(F)(F)F)ccc23)cccc1C(=O)NCc1ccncc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDR P35968 9/20 0.46
AURKA O14965 4/20 0.46
TEK Q02763 4/20 0.46
MET P08581 3/20 0.46
LCK P06239 3/20 0.46
AURKB Q96GD4 2/20 0.46
NAMPT P43490 1/20 0.46
ROCK2 O75116 2/20 0.46
ROCK1 Q13464 1/20 0.46
POLB P06746 1/20 0.45
GPR52 Q9Y2T5 1/20 0.45
FLT1 P17948 3/20 0.45
MAPK14 Q16539 1/20 0.43
PPARG P37231 1/20 0.43
PPARD Q03181 1/20 0.43
PPARA Q07869 1/20 0.43
MAPK1 P28482 1/20 0.43
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42

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
SCHEMBL22972321 0.90 KDR (0.56) KDRAURKATEKMETLCK
SCHEMBL22971978 0.88 POLB (0.49) KDRAURKATEKMETLCK
SCHEMBL22972196 0.88 SORT1 (0.51) KDRAURKATEKMETLCK
SCHEMBL22972348 0.87 POLB (0.47) KDRAURKATEKMETLCK
SCHEMBL22971946 0.86 MAPT (0.48) KDRAURKATEKMETLCK
SCHEMBL22972029 0.86 POLB (0.48) KDRAURKATEKMETLCK
SCHEMBL22971870 0.86 POLB (0.48) KDRAURKATEKMETPOLB
SCHEMBL22971899 0.86 POLB (0.48) KDRAURKATEKMETLCK
SCHEMBL22972316 0.85 POLB (0.57) POLBMAPK14MAPK1CYP3A4
SCHEMBL22972043 0.85 KDR (0.58) KDRAURKATEKMETLCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220388979-A1 QUINOLINE DERIVATIVES AS PROTEIN KINASE INHIBITORS B.C.I. PHARMA (BE) 2022-12-08 US disclosed
WO-2021023888-A1 ISOQUINOLINE DERIVATIVES AS PROTEIN KINASE INHIBITORS B.C.I. PHARMA (BE) 2021-02-11 WO 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-20220388979-A1 QUINOLINE DERIVATIVES AS PROTEIN KINASE INHIBITORS ABL1, PHKB, EEF2K KDR 604/4885AURKA 245/4885TEK 2070/4885

“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.