SCHEMBL6212924

SCHEMBL6212924

CC(C)(C)N(S)C(=O)N[C@@H](CO)Cc1ccc(O)cc1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.44
PCNA P12004 3/20 0.44
CYP3A4 P08684 1/20 0.42
MAPK1 P28482 1/20 0.42
LMNA P02545 1/20 0.39
ESR1 P03372 2/20 0.38
ESR2 Q92731 2/20 0.38
ACE P12821 2/20 0.37
MME P08473 1/20 0.37
OPRM1 P35372 1/20 0.37
FOLH1 Q04609 1/20 0.36
OPRD1 P41143 1/20 0.36
OPRK1 P41145 1/20 0.36

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
SCHEMBL6209687 1.00 CNR1 (0.44) CNR1PCNACYP3A4MAPK1LMNA
SCHEMBL6211338 0.79 POLB (0.31)
SCHEMBL11989410 0.76 PCNA (0.61) CNR1PCNACYP3A4MAPK1LMNA
SCHEMBL12586354 0.76 CNR1 (0.52) CNR1PCNACYP3A4MAPK1LMNA
SCHEMBL19223470 0.76 CNR1 (0.53) CNR1PCNACYP3A4MAPK1LMNA
SCHEMBL19223468 0.76 CNR1 (0.53) CNR1PCNACYP3A4MAPK1LMNA
SCHEMBL6479222 0.75 CTSS (0.57) CNR1PCNACYP3A4MAPK1
SCHEMBL6479279 0.75 CTSS (0.57) CNR1PCNACYP3A4MAPK1
SCHEMBL6479218 0.75 CTSS (0.57) CNR1PCNACYP3A4MAPK1
SCHEMBL6190633 0.75 CNR1 (0.51) CNR1PCNACYP3A4MAPK1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1299365-B1 2-AMINOTHIAZOLINE DERIVATIVES AND THEIR USE AS NO-SYNTHASE INHIBITORS AVENTIS PHARMA SA (FR) 2005-09-28 EP disclosed
US-6699895-B2 CYCLIZING THE TERT-BUTYL-THIOUREA DERIVATIVE TO FORM THE END PRODUCT AVENTIS PHARMA S.A. (FR) 2004-03-02 US disclosed
US-20020187987-A1 Use of 2-aminothiazoline derivatives as inhibitors of inducible NO-synthase CARRY JEAN-CHRISTOPHE (FR) 2002-12-12 US disclosed
US-6451821-B1 ADMINISTERING TO A PATIENT A THERAPEUTICALLY EFFECTIVE AMOUNT OF 2-AMINOTHIAZOLINE DERIVATIVES FOR TREATING OR PREVENTING DISEASE CONDITIONS ASSOCIATED WITH AN ABNORMAL PRODUCTION OF NITRIC OXIDE(NO) AVENTIS PHARMA S.A. (FR) 2002-09-17 US disclosed
US-20020022631-A1 Use of 2-aminothiazoline derivatives as inhibitors of inducible no-synthase AVENTIS PHARMA S.A. (FR) 2002-02-21 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-20020022631-A1 Use of 2-aminothiazoline derivatives as inhibitors of inducible no-synthase NOS2, NOS3, NOS1 CNR1 454/4885PCNA 4389/4885CYP3A4 31/4885
US-20020187987-A1 Use of 2-aminothiazoline derivatives as inhibitors of inducible NO-synthase NOS2, NOS3, NOS1 CNR1 390/4885PCNA 4240/4885CYP3A4 38/4885

“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.