SCHEMBL7107720

SCHEMBL7107720

CC(NC(=O)OCc1ccccc1)C(=O)NC(=O)OC1CCCCC1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.57
CTSK P43235 9/20 0.51
PREP P48147 2/20 0.51
CTSL P07711 3/20 0.50
CTSS P25774 3/20 0.50
ELANE P08246 1/20 0.48
MEN1 O00255 1/20 0.47
LMNA P02545 1/20 0.47
KMT2A Q03164 1/20 0.47
CYP3A4 P08684 2/20 0.47
TSHR P16473 2/20 0.47
CTSB P07858 1/20 0.47
ALDH1A1 P00352 1/20 0.46

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
SCHEMBL26276986 0.88 CYP1A2 (0.55) CYP1A2CTSKPREPCTSLCTSS
SCHEMBL607313 0.88 CYP1A2 (0.55) CYP1A2CTSKPREPCTSLCTSS
SCHEMBL28855000 0.88 CYP1A2 (0.55) CYP1A2CTSKPREPCTSLCTSS
SCHEMBL31723013 0.87 CYP1A2 (0.56) CYP1A2CTSKPREPCTSLCTSS
SCHEMBL11431644 0.82 ALDH1A1 (0.61) CYP1A2CTSKPREPELANEMEN1
SCHEMBL18800854 0.81 CYP1A2 (0.61) CYP1A2CTSKPREPCTSLCTSS
SCHEMBL11436545 0.81 ALDH1A1 (0.59) CYP1A2CTSKPREPCTSLELANE
SCHEMBL28060962 0.80 CYP1A2 (0.56) CYP1A2CTSKPREPCTSLCTSS
SCHEMBL15081415 0.80 CYP1A2 (0.56) CYP1A2CTSKPREPCTSLCTSS
SCHEMBL5400651 0.79 CACNA1B (0.52) CYP1A2CTSKCTSLCTSSCTSB

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-20030013725-A1 Amino acid derivatives ONO PHARMACEUTICAL CO., LTD. 2003-01-16 US claimed

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-20030013725-A1 Amino acid derivatives CACNA1B, SCN1A, SCN2A CYP1A2 1895/4885CTSK 3691/4885PREP 3149/4885

“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.