SCHEMBL5096121

SCHEMBL5096121

NC(=O)C(N)Cc1ccc(Cl)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 1/20 0.57
SLC6A3 Q01959 2/20 0.53
SLC6A2 P23975 1/20 0.53
DPP4 P27487 3/20 0.49
SLC7A5 Q01650 2/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
PTGS1 P23219 2/20 0.47
ALPI P09923 1/20 0.47
PKM P14618 1/20 0.47
XIAP P98170 1/20 0.47
CTSC P53634 1/20 0.47
PPARG P37231 1/20 0.46
PPARA Q07869 1/20 0.46
FAP Q12884 1/20 0.46
DPP8 Q6V1X1 1/20 0.46
DPP9 Q86TI2 1/20 0.46
DPP7 Q9UHL4 1/20 0.46
TPH1 P17752 1/20 0.45
ACACB O00763 1/20 0.44

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
SCHEMBL8122168 1.00 SLC6A4 (0.57) SLC6A4SLC6A3SLC6A2DPP4SLC7A5
SCHEMBL6317469 1.00 SLC6A4 (0.57) SLC6A4SLC6A3SLC6A2DPP4SLC7A5
Hydrochloric Acid SCHEMBL8335060 0.98 SLC6A4 (0.55) SLC6A4SLC6A3SLC6A2DPP4SLC7A5
Fenclonine SCHEMBL26382 0.84 SLC7A5 (0.69) SLC6A4SLC6A3SLC6A2SLC7A5PTGS1
SCHEMBL4654874 0.84 SLC6A2 (0.59) SLC6A4SLC6A3SLC6A2DPP4SLC7A5
Fenclonine SCHEMBL26383 0.84 SLC7A5 (0.69) SLC6A4SLC6A3SLC6A2SLC7A5PTGS1
Fenclonine SCHEMBL3140768 0.84 SLC7A5 (0.69) SLC6A4SLC6A3SLC6A2SLC7A5PTGS1
SCHEMBL12104067 0.84 SLC6A2 (0.59) SLC6A4SLC6A3SLC6A2DPP4SLC7A5
SCHEMBL12188513 0.84 SLC6A2 (0.59) SLC6A4SLC6A3SLC6A2DPP4SLC7A5
Fenclonine SCHEMBL245828 0.84 SLC7A5 (0.69) SLC6A4SLC6A3SLC6A2SLC7A5PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1589403-B Methods of assaying connective tissue growth factor FIBROGEN INC 2011-06-01 CN disclosed
US-20080207677-A1 Napthyridine Compounds As Rock Inhibitors GPC BIOTECH AG (DE) 2008-08-28 US disclosed
US-6949658-B2 Process for producing optically active α-amino acid and optically active α-amino acid amide MITSUBISHI RAYON CO., LTD. (JP) 2005-09-27 US disclosed
CN-1589403-A Methods of assaying connective tissue growth factor FIBROGEN INC (US) 2005-03-02 CN disclosed
US-20030171597-A1 Process for producing optically active alpha-amino acid and optically active alpha-amino acid amine MITSUBISHI RAYON CO., LTD. (JP) 2003-09-11 US disclosed
EP-1300392-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE ALPHA-AMINO ACID AND OPTICALLY ACTIVE ALPHA-AMINO ACID AMIDE Mitsubishi Rayon Co., Ltd. (JP) 2003-04-09 EP disclosed
EP-0495013-B1 HEXAPEPTIDES WITH SULPHATE ESTER GROUPS FISONS CORP (US) 1995-03-08 EP disclosed
EP-0226217-B1 Peptides with sulfate ester group FISONS CORP (US) 1994-01-26 EP disclosed
EP-0495013-A1 HEXAPEPTIDES WITH SULPHATE ESTER GROUPS. FISONS CORP (US) 1992-07-22 EP disclosed
WO-1991008225-A1 HEXAPEPTIDES WITH SULPHATE ESTER GROUPS FISONS CORPORATION (US) 1991-06-13 WO disclosed
EP-0193083-A1 Anti-tumoral(1-arylmethyl-ethylene diamine)-platinum(II)-complexes ASTA Pharma AG (DE) 1986-09-03 EP 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-20030171597-A1 Process for producing optically active alpha-amino acid and optically active alpha-amino acid amine AADAT, BCAT1, BCAT2 SLC6A4 1580/4885SLC6A3 1676/4885SLC6A2 1564/4885
US-20080207677-A1 Napthyridine Compounds As Rock Inhibitors ROCK2, ROCK1, RHOT2 SLC6A4 426/4885SLC6A3 487/4885SLC6A2 49/4885

“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.