SCHEMBL14975157

SCHEMBL14975157

CC[C@H](NC(=O)O)[C@H](O)C(=O)NC1CC1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.43
SMYD3 Q9H7B4 2/20 0.39
EPHX1 P07099 1/20 0.38
KMT2A Q03164 2/20 0.38
SIGMAR1 Q99720 1/20 0.35
KDM4E B2RXH2 1/20 0.34
LMNA P02545 2/20 0.33
MEN1 O00255 1/20 0.33
BLM P54132 1/20 0.33
CASP6 P55212 1/20 0.33
GPR88 Q9GZN0 1/20 0.32
HPGD P15428 1/20 0.32

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
SCHEMBL3729020 0.87 SMN1; SMN2 (0.38) L3MBTL1SMYD3EPHX1KMT2ASIGMAR1
SCHEMBL3719801 0.87 SMN1; SMN2 (0.38) L3MBTL1SMYD3EPHX1KMT2ASIGMAR1
SCHEMBL19975443 0.80 MEN1 (0.55) KMT2ALMNAMEN1
SCHEMBL4098800 0.80 CPB2 (0.41) EPHX1KMT2AHPGD
Hydrochloric Acid SCHEMBL16007751 0.78 HDAC4 (0.46) EPHX1KMT2A
SCHEMBL21526199 0.76 TDP1 (0.48) L3MBTL1KDM4EHPGD
SCHEMBL1989246 0.76 TDP1 (0.48) L3MBTL1KDM4EHPGD
SCHEMBL3274629 0.75 GPR88 (0.37) L3MBTL1SMYD3EPHX1KMT2ASIGMAR1
SCHEMBL842056 0.74 SMYD3 (0.45) L3MBTL1SMYD3EPHX1KMT2ASIGMAR1
SCHEMBL2362012 0.74 SMYD3 (0.45) L3MBTL1SMYD3EPHX1KMT2ASIGMAR1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2782903-B1 NOVEL PYRROLIDINE DERIVATIVES AS INHIBITORS OF CATHEPSIN HOFFMANN LA ROCHE (CH) 2016-04-06 EP disclosed
US-8729061-B2 Pyrrolidine derivatives HOFFMANN-LA ROCHE INC. (US) 2014-05-20 US disclosed
US-20130137687-A1 NOVEL PYRROLIDINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2013-05-30 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-20130137687-A1 NOVEL PYRROLIDINE DERIVATIVES PYCR1, PRMT7, PRLHR L3MBTL1 4342/4885SMYD3 3271/4885EPHX1 2894/4885

“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.