SCHEMBL14865867

SCHEMBL14865867

CC(=O)N[C@@H](Cc1ccccc1)C(=O)CCl

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTSG P08311 3/20 0.62
CMA1 P23946 3/20 0.62
CTSS P25774 1/20 0.58
CTSK P43235 1/20 0.58
PAM P19021 1/20 0.58
CTRB1 P17538 4/20 0.54
TACR1 P25103 1/20 0.53
LMNA P02545 2/20 0.51
GNPAT O15228 1/20 0.51
ACE P12821 1/20 0.50
ALDH1A1 P00352 1/20 0.49
HTT P42858 1/20 0.49
NCOA1 Q15788 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
NCOA3 Q9Y6Q9 1/20 0.49

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
SCHEMBL14363442 1.00 CTSG (0.62) CTSGCMA1CTSSCTSKPAM
SCHEMBL13857697 0.89 CTSG (0.54) CTSGCMA1CTSSCTSKPAM
SCHEMBL6942656 0.87 CTSG (0.65) CTSGCMA1ACEALDH1A1HTT
SCHEMBL4291672 0.87 CTSG (0.65) CTSGCMA1ACEALDH1A1HTT
SCHEMBL5664274 0.87 CTSG (0.65) CTSGCMA1ACEALDH1A1HTT
SCHEMBL20079849 0.85 CTSS (0.60) CTSSCTSKPAMCTRB1TACR1
SCHEMBL14865877 0.85 CTSS (0.60) CTSSCTSKPAMCTRB1TACR1
SCHEMBL7499927 0.84 CTSG (0.59) CTSGCMA1CTSSCTSKACE
SCHEMBL7486728 0.84 CTSG (0.59) CTSGCMA1CTSSCTSKACE
SCHEMBL4976559 0.84 CTSG (0.59) CTSGCMA1CTSSCTSKACE

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-20130096317-A1 REDUCTION OF ALDEHYDES AND KETONES TO ALCOHOLS GEORGIA TECH RESEARCH CORPORATION (US) 2013-04-18 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-20130096317-A1 REDUCTION OF ALDEHYDES AND KETONES TO ALCOHOLS POF1B, PHF2, ADH1C CTSG 4804/4885CMA1 1440/4885CTSS 4614/4885

“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.