SCHEMBL2209642

SCHEMBL2209642

COc1cc(F)cc2nccc(Oc3ccc(Nc4nnc(-c5ccc(Cl)cc5)c5ccccc45)cc3)c12

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDR P35968 6/20 0.49
MAPT P10636 4/20 0.48
LMNA P02545 1/20 0.48
AURKA O14965 1/20 0.46
AURKB Q96GD4 1/20 0.46
TPX2 Q9ULW0 1/20 0.46
FGFR2 P21802 2/20 0.46
ENPP3 O14638 3/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
PDGFRA P16234 1/20 0.44
TP53 P04637 1/20 0.43
GAA P10253 1/20 0.43
ALDH1A1 P00352 1/20 0.43
THRB P10828 1/20 0.43
HTT P42858 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL2210511 0.92 MAPT (0.52) KDRMAPTLMNAFGFR2ENPP3
SCHEMBL2210774 0.85 AURKA (0.49) KDRMAPTLMNAAURKAAURKB
SCHEMBL2210989 0.85 KDR (0.48) KDRMAPTLMNAAURKAAURKB
SCHEMBL15663382 0.84 MAPT (0.54) KDRMAPTLMNAFGFR2ENPP3
SCHEMBL2209315 0.84 MAPT (0.54) KDRMAPTLMNAFGFR2ENPP3
SCHEMBL2204739 0.83 AURKA (0.47) KDRMAPTLMNAAURKAAURKB
SCHEMBL2211004 0.83 AURKA (0.54) KDRMAPTLMNAAURKAAURKB
SCHEMBL2209628 0.81 MAPT (0.52) KDRMAPTLMNAFGFR2ENPP3
SCHEMBL2211010 0.80 FGFR2 (0.40) KDRMAPTLMNAAURKAAURKB
SCHEMBL2210856 0.80 KDR (0.51) KDRMAPTLMNAAURKAAURKB

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
US-7981891-B2 Aurora kinase modulators and method of use AMGEN INC. (US) 2011-07-19 US claimed
US-20100280008-A1 AURORA KINASE MODULATORS AND METHOD OF USE AMGEN INC. (US) 2010-11-04 US claimed
EP-2137177-B1 AURORA KINASE MODULATORS AND METHOD OF USE AMGEN INC (US) 2014-05-07 EP 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-20100280008-A1 AURORA KINASE MODULATORS AND METHOD OF USE AURKC, AURKA, CDK1 KDR 644/4885MAPT 1693/4885LMNA 796/4885

“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.