SCHEMBL6194635

SCHEMBL6194635

C=CCOC(=O)C(C)(O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.41
CYP3A4 P08684 2/20 0.39
TDP1 Q9NUW8 1/20 0.38
MAPT P10636 2/20 0.37
CACNA1B Q00975 1/20 0.37
APBA1 Q02410 1/20 0.37
ALDH1A1 P00352 3/20 0.34
HSD17B10 Q99714 2/20 0.34
SMN1; SMN2 Q16637 3/20 0.33
TP53 P04637 2/20 0.33
MAPK1 P28482 1/20 0.33
HIF1A Q16665 1/20 0.33
RHOA P61586 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
KDM4E B2RXH2 1/20 0.31
HPGD P15428 1/20 0.31
PKM P14618 1/20 0.31
SNCA P37840 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 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
SCHEMBL877587 0.86 TSHR (0.41) TSHRCYP3A4TDP1MAPTCACNA1B
SCHEMBL7866089 0.84 TSHR (0.42) TSHRCYP3A4TDP1MAPTCACNA1B
SCHEMBL194466 0.84 TSHR (0.42) TSHRCYP3A4TDP1MAPTCACNA1B
SCHEMBL8165023 0.83 TSHR (0.39) TSHRCYP3A4TDP1MAPTCACNA1B
SCHEMBL10454577 0.83 MAPT (0.39) TSHRCYP3A4TDP1MAPTCACNA1B
SCHEMBL4675516 0.82 TSHR (0.41) TSHRCYP3A4TDP1MAPTCACNA1B
SCHEMBL8517677 0.82 TSHR (0.41) TSHRCYP3A4TDP1MAPTCACNA1B
SCHEMBL9778370 0.81 TSHR (0.38) TSHRCYP3A4TDP1MAPTCACNA1B
SCHEMBL28947725 0.81 TSHR (0.42) TSHRCYP3A4TDP1MAPTCACNA1B
SCHEMBL4673298 0.80 TDP1 (0.41) TSHRCYP3A4TDP1MAPTCACNA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1086093-B1 TETRAHYDROQUINOLINE DERIVATIVES AS GLYCINE ANTAGONISTS GLAXOSMITHKLINE SPA (IT) 2005-08-10 EP disclosed
US-6495566-B2 POTENT ANTAGONISTS AT THE STRYCHNINE INSENSITIVE GLYCINE BINDING SITE ASSOCIATED WITH THE N-METHYLASPARTIC ACID RECEPTOR COMPLEX SMITHKLINE BEECHAM CORPORATION 2002-12-17 US disclosed
US-20020169186-A1 TETRAHYDROQUINOLINE DERIVATIVES AS GLYCINE ANTAGONISTS DI FABIO ROMANO (IT) 2002-11-14 US disclosed
US-6413985-B1 SELECTIVE ANTAGONISTS FOR THE STRYCHNINE INSENSITIVE GLYCINE BINDING SITE ASSOCIATED WITH THE NMDA RECEPTOR COMPLEX. SMITHKLINE BEECHAM CORPORATION 2002-07-02 US disclosed
US-20020052391-A1 Tetrahydroquinoline derivatives as glycine antagonists DI FABIO ROMANO (IT) 2002-05-02 US disclosed
US-6362199-B1 CENTRAL NERVOUS SYSTEM DISORDERS; PSYCHOLOGICAL DISORDERS SMITHKLINE BEECHAM CORPORATION 2002-03-26 US disclosed
EP-1086093-A1 TETRAHYDROQUINOLINE DERIVATIVES AS GLYCINE ANTAGONISTS GLAXO WELLCOME S.p.A. (IT) 2001-03-28 EP disclosed
WO-1999064411-A1 TETRAHYDROQUINOLINE DERIVATIVES AS GLYCINE ANTAGONISTS GLAXO WELLCOME SPA (IT) 1999-12-16 WO disclosed
EP-0706543-B1 MODULAR SYSTEM AND PROCESS FOR PRODUCING AQUEOUS COATING COMPOSITIONS HERBERTS & CO GMBH (DE) 1997-11-05 EP disclosed
EP-0706543-A1 MODULAR SYSTEM AND PROCESS FOR PRODUCING AQUEOUS COATING COMPOSITIONS Herberts Gesellschaft mit beschränkter Haftung (DE) 1996-04-17 EP disclosed
WO-1995029960-A1 MODULAR SYSTEM AND PROCESS FOR PRODUCING AQUEOUS COATING COMPOSITIONS Herberts Gesellschaft mit beschränkter Haftung (DE) 1995-11-09 WO disclosed
EP-0337422-A2 Waterdilutable binders and their use as coatings especially in the car industry Herberts Gesellschaft mit beschränkter Haftung (DE) 1989-10-18 EP disclosed
EP-0260448-A2 Externally cross-linkable binder combination, aqueous coating compositions containing it and its use Herberts Gesellschaft mit beschränkter Haftung (DE) 1988-03-23 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-20020052391-A1 Tetrahydroquinoline derivatives as glycine antagonists GLRB, GLRA2, GLRA1 TSHR 175/4885CYP3A4 984/4885TDP1 4518/4885
US-20020169186-A1 TETRAHYDROQUINOLINE DERIVATIVES AS GLYCINE ANTAGONISTS GLRA1, GRM1, GNMT TSHR 1468/4885CYP3A4 240/4885TDP1 3915/4885

“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.