SCHEMBL3845157

SCHEMBL3845157

NCCN[C@H](Cc1c[nH]cn1)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 8/20 0.55
CPB1 P15086 1/20 0.55
GGT1 P19440 1/20 0.41
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C19 P33261 1/20 0.33
SLC15A2 Q16348 1/20 0.31

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
SCHEMBL3839540 1.00 CPB2 (0.55) CPB2CPB1GGT1ALDH1A1CYP1A2
SCHEMBL2776305 0.92 CPB2 (0.49) CPB2CPB1GGT1ALDH1A1CYP1A2
SCHEMBL1079150 0.89 CPB2 (0.47) CPB2CPB1SLC15A2
SCHEMBL7738753 0.86 CPB2 (0.49) CPB2CPB1ALDH1A1CYP1A2CYP3A4
SCHEMBL7738755 0.86 CPB2 (0.49) CPB2CPB1ALDH1A1CYP1A2CYP3A4
SCHEMBL29071837 0.84 CPB2 (0.50) CPB2CPB1GGT1ALDH1A1CYP1A2
SCHEMBL4247225 0.84 CPB2 (0.40) CPB2CPB1
SCHEMBL4247228 0.84 CPB2 (0.40) CPB2CPB1
SCHEMBL7074055 0.84 CPB2 (0.40) CPB2CPB1GGT1ALDH1A1CYP1A2
SCHEMBL10777853 0.84 CPB2 (0.40) CPB2CPB1GGT1ALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1311488-B1 SUBSTITUTED IMIDAZOLES AS TAFIA INHIBITORS PFIZER LTD (GB) 2009-11-04 EP disclosed
US-6949577-B2 Pharmaceuticals PFIZER, INC. (US) 2005-09-27 US disclosed
US-20030236420-A1 Pharmaceuticals ALLERTON CHARLOTTE MOIRA NORFO (GB) 2003-12-25 US disclosed
US-20020147229-A1 Pharmaceuticals PFIZER INC. 2002-10-10 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 (2 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-20020147229-A1 Pharmaceuticals BDKRB1, TFPI, BDKRB2 CPB2 234/4885CPB1 168/4885GGT1 1034/4885
US-20030236420-A1 Pharmaceuticals BDKRB1, TFPI, SERPINE1 CPB2 167/4885CPB1 181/4885GGT1 992/4885

“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.