SCHEMBL434102

SCHEMBL434102

Clc1cc(Cl)c2c[c][nH]c2c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 3/20 0.40
ALDH1A1 P00352 3/20 0.36
HSD17B10 Q99714 2/20 0.36
GRIN2D O15399 2/20 0.36
GRIN3B O60391 2/20 0.36
GRIN2A Q12879 2/20 0.36
GRIN2B Q13224 2/20 0.36
GRIN2C Q14957 2/20 0.36
GRIN3A Q8TCU5 2/20 0.36
KDM4E B2RXH2 1/20 0.36
GAA P10253 1/20 0.36
HTT P42858 1/20 0.34
TSHR P16473 3/20 0.33
CYP3A4 P08684 1/20 0.33
RECQL P46063 1/20 0.33
CA12 O43570 1/20 0.31
CA9 Q16790 1/20 0.31
AHR P35869 1/20 0.30
MEN1 O00255 1/20 0.30
CYP1A2 P05177 1/20 0.30

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
SCHEMBL9742121 0.68 ALDH1A1 (0.34) ALDH1A1CYP3A4
SCHEMBL4276905 0.68 CYP1A2 (0.46) GAATSHRCYP1A2
SCHEMBL207242 0.67 ALDH1A1 (0.56) GRIN1ALDH1A1GRIN2DGRIN3BGRIN2A
SCHEMBL1040998 0.65 ALDH1A1 (0.56) GRIN1ALDH1A1HSD17B10KDM4EHTT
SCHEMBL9740520 0.65 CHUK (0.39) GRIN1ALDH1A1GRIN2DGRIN3BGRIN2A
SCHEMBL1022450 0.64 RHEB (0.58) GRIN1ALDH1A1HTTAHR
SCHEMBL29531208 0.64 RHEB (0.58) GRIN1ALDH1A1HTTAHR
SCHEMBL2715277 0.64 ALDH1A1 (0.39) GRIN1ALDH1A1HSD17B10GRIN2DGRIN3B
SCHEMBL669692 0.62 GRIN1 (0.52) GRIN1ALDH1A1HSD17B10GRIN2DGRIN3B
SCHEMBL14487466 0.62 METAP2 (0.56) GRIN1HTT

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 37 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1351688-A4 UROTENSIN-II RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2006-01-04 EP claimed
US-20040053963-A1 Urotensin-II receptor antagonists SMITHKLINE BEECHAM CORPORATION 2004-03-18 US claimed
US-20040039017-A1 Urotensin-II receptor antagonists SMITHKLINE BEECHAM CORPORATION 2004-02-26 US claimed
EP-1351687-A4 UROTENSIN-II RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2004-01-21 EP claimed
EP-1351687-A2 UROTENSIN-II RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2003-10-15 EP claimed
EP-1351688-A1 UROTENSIN-II RECEPTOR ANTAGONISTS SmithKline Beecham Corporation (US) 2003-10-15 EP claimed
WO-2002047456-A2 UROTENSIN-II RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2002-06-20 WO claimed
WO-2002047687-A1 UROTENSIN-II RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2002-06-20 WO claimed
EP-2588219-B1 FILTER PLATE ARTICLE HAVING A WATER-ABSORBENT FILTER ASSEMBLY NEOGEN FOOD SAFETY US HOLDCO CORP (US) 2024-05-29 EP disclosed
CN-111050765-B Spiro compounds and methods of making and using the same H.隆德贝克有限公司 2024-01-02 CN disclosed
CN-111050765-A Spiro compounds and methods of making and using the same 隆德贝克拉荷亚研究中心有限公司 2020-04-21 CN disclosed
US-20130184258-A1 Compositions Useful as Inhibitors of Voltage-Gated Sodium Channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-07-18 US disclosed
EP-2588219-A2 FILTER PLATE ARTICLE HAVING A WATER-ABSORBENT FILTER ASSEMBLY 3M Innovative Properties Company (US) 2013-05-08 EP disclosed
US-8309543-B2 Compositions useful as inhibitors of voltage-gated sodium channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-11-13 US disclosed
US-20040039017-A1 Urotensin-II receptor antagonists SMITHKLINE BEECHAM CORPORATION 2004-02-26 US disclosed
EP-1351687-A4 UROTENSIN-II RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2004-01-21 EP disclosed
EP-1351687-A2 UROTENSIN-II RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2003-10-15 EP disclosed
EP-1351688-A1 UROTENSIN-II RECEPTOR ANTAGONISTS SmithKline Beecham Corporation (US) 2003-10-15 EP disclosed
WO-2002047456-A2 UROTENSIN-II RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2002-06-20 WO disclosed
WO-2002047687-A1 UROTENSIN-II RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2002-06-20 WO 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 (3 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-20130184258-A1 Compositions Useful as Inhibitors of Voltage-Gated Sodium Channels SCNN1G, KCNN3, KCNN2 GRIN1 177/4885ALDH1A1 2811/4885HSD17B10 2209/4885
US-20040039017-A1 Urotensin-II receptor antagonists UTS2R, NTSR2, PLAUR GRIN1 2702/4885ALDH1A1 4300/4885HSD17B10 3329/4885
US-20040053963-A1 Urotensin-II receptor antagonists UTS2R, NTSR2, TMPRSS2 GRIN1 3268/4885ALDH1A1 4513/4885HSD17B10 3303/4885

“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.