SCHEMBL26048947

SCHEMBL26048947

CCCCCOC[C@H](C)NC(=O)OC(C)(C)C

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTSK P43235 10/20 0.48
PLA2G2C Q5R387 4/20 0.46
CTSS P25774 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA7 P43166 1/20 0.43
ALDH1A1 P00352 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C19 P33261 1/20 0.40

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
SCHEMBL2114161 0.86 TDP1 (0.45) CTSKCTSSCA1CA2CA7
SCHEMBL536993 0.86 TDP1 (0.45) CTSKCTSSCA1CA2CA7
SCHEMBL38659918 0.86 TDP1 (0.45) CTSKCTSSCA1CA2CA7
SCHEMBL24485595 0.85 PLA2G2C (0.57) CTSKPLA2G2CCTSS
SCHEMBL2836699 0.85 PLA2G2C (0.57) CTSKPLA2G2CCTSS
SCHEMBL19084258 0.84 CA1 (0.53) CTSKCTSSCA1CA2CA7
SCHEMBL22405806 0.83 CA1 (0.46) CTSKCTSSCA1CA2CA7
SCHEMBL22405809 0.83 CA1 (0.46) CTSKCTSSCA1CA2CA7
SCHEMBL22405880 0.83 CA1 (0.46) CTSKCTSSCA1CA2CA7
SCHEMBL31407501 0.82 PPARA (0.52) CTSKPLA2G2CCTSS

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-20230250097-A1 BENZO[C][2,6]NAPHTHYRIDINE DERIVATIVES, COMPOSITIONS AND THERAPEUTIC USES THEREOF Apollo Therapeutics Limited (GB) 2023-08-10 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-20230250097-A1 BENZO[C][2,6]NAPHTHYRIDINE DERIVATIVES, COMPOSITIONS AND THERAPEUTIC USES THEREOF CSNK1A1, CSNK1D, CSNK2A1 CTSK 1506/4885PLA2G2C 2384/4885CTSS 2352/4885

“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.