SCHEMBL10249580

SCHEMBL10249580

CCn1c(-c2cccc(NC(=O)OC)c2)c(N)c2ccc(OCCN3CCOCC3)cc21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 13/20 0.45
KDR P35968 1/20 0.44
CDC7 O00311 1/20 0.43
PLK4 O00444 1/20 0.43
AURKA O14965 1/20 0.43
DAPK3 O43293 1/20 0.43
ROCK2 O75116 1/20 0.43
RPS6KA5 O75582 1/20 0.43
PRKD3 O94806 1/20 0.43
PRKCG P05129 1/20 0.43
LCK P06239 1/20 0.43
PIM1 P11309 1/20 0.43
PRKACA P17612 1/20 0.43
RPS6KB1 P23443 1/20 0.43
CDK2 P24941 1/20 0.43
MARK3 P27448 1/20 0.43
AKT1 P31749 1/20 0.43
AKT2 P31751 1/20 0.43
FLT4 P35916 1/20 0.43
FLT3 P36888 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
SCHEMBL10097322 0.94 CDC7 (0.46) EPHX2KDRCDC7PLK4AURKA
SCHEMBL10097445 0.90 EPHX2 (0.49) EPHX2
SCHEMBL10252435 0.90 EPHX2 (0.49) EPHX2
SCHEMBL10097681 0.90 EPHX2 (0.49) EPHX2
SCHEMBL10097731 0.89 EPHX2 (0.47) EPHX2
SCHEMBL10097527 0.87 EPHX2 (0.48) EPHX2KDR
SCHEMBL10097697 0.87 EPHX2 (0.53) EPHX2
SCHEMBL10097800 0.85 EPHX2 (0.51) EPHX2
SCHEMBL10097493 0.85 EPHX2 (0.51) EPHX2KDRAURKAAURKB
SCHEMBL10097406 0.84 EPHX2 (0.50) EPHX2KDR

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-20120009142-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2012-01-12 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-20120009142-A1 METHODS FOR TREATING HEPATITIS C OAT, HAVCR2, HCCS EPHX2 1777/4885KDR 4817/4885CDC7 2487/4885

“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.