SCHEMBL29346359

SCHEMBL29346359

COCCCOC(=O)Cc1ccccc1OCc1nn(CC2CCC2)c2ccc(-c3ccc4ccnc(N)c4c3)cc12

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CFD P00746 1/20 0.36
ICMT O60725 5/20 0.34
PTGER4 P35408 3/20 0.34
PLA2G2A P14555 1/20 0.30
KDM4C Q9H3R0 1/20 0.30
CNR1 P21554 1/20 0.30

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
SCHEMBL29122050 0.91 CFD (0.44) CFDICMTPLA2G2AKDM4C
SCHEMBL29121688 0.87 CFD (0.37) CFDICMTKDM4C
SCHEMBL29122224 0.85 CFD (0.41) CFDICMTPTGER4
SCHEMBL29345883 0.84 EGFR (0.35) CFD
SCHEMBL29123263 0.84 CFD (0.43) CFDICMT
SCHEMBL29123103 0.83 CFD (0.44) CFDPTGER4
SCHEMBL29123168 0.83 CFD (0.42) CFDICMTPTGER4
SCHEMBL29123379 0.82 CFD (0.34) CFDICMTPTGER4
SCHEMBL29121864 0.82 CFD (0.43) CFDICMTKDM4CCNR1
SCHEMBL29122218 0.81 CFD (0.46) CFDICMT

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-20240239752-A1 BICYCLIC HETEROAROMATIC INHIBITORS OF KLK5 WILMINGTON TRUST, NATIONAL ASSOCIATION 2024-07-18 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-20240239752-A1 BICYCLIC HETEROAROMATIC INHIBITORS OF KLK5 KLK5, KLK1, KLKB1 CFD 3529/4885ICMT 4826/4885PTGER4 3145/4885

“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.