SCHEMBL23633248

SCHEMBL23633248

O=C(N[C@@H](Cc1cccc(Cl)c1)C(=O)O)c1ccc(Cl)s1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
C3AR1 Q16581 2/20 0.52
CTSV O60911 9/20 0.49
CTSL P07711 9/20 0.49
CTSS P25774 9/20 0.49
CTSK P43235 8/20 0.49
CTSB P07858 7/20 0.49
F10 P00742 1/20 0.48
PYGL P06737 1/20 0.47
HTRA1 Q92743 1/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
TLR3 O15455 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
PIN1 Q13526 1/20 0.45

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
SCHEMBL23633238 0.85 HTRA1 (0.51) CTSVCTSLCTSSCTSKCTSB
SCHEMBL23279689 0.81 CTSV (0.70) CTSVCTSLCTSSCTSKCTSB
SCHEMBL23279600 0.81 CTSL (0.70) C3AR1CTSVCTSLCTSSCTSK
SCHEMBL20591555 0.81 CTSV (0.70) CTSVCTSLCTSSCTSKCTSB
SCHEMBL25045736 0.79 CTSL (0.52) CTSVCTSLCTSSCTSKCTSB
SCHEMBL3451680 0.78 FPR2 (0.49) CTSVCTSLCTSSCTSKCTSB
SCHEMBL3451686 0.78 FPR2 (0.49) CTSVCTSLCTSSCTSKCTSB
SCHEMBL29981912 0.78 FOLH1 (0.52) CTSVCTSLCTSSCTSKCTSB
SCHEMBL27477804 0.78 CTSL (0.53) CTSVCTSLCTSSCTSKCTSB
SCHEMBL27552211 0.78 CTSL (0.53) CTSVCTSLCTSSCTSKCTSB

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-11059858-B2 Difluoroketamide derivatives as HtrA1 inhibitors HOFFMANN-LA ROCHE INC. (US) 2021-07-13 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-11059858-B2 Difluoroketamide derivatives as HtrA1 inhibitors HTRA1, HTR1A, HTR1E C3AR1 511/4885CTSV 1331/4885CTSL 2311/4885

“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.