SCHEMBL2757

SCHEMBL2757

[CH2]CCC12CC3CC(CC(C3)C1)C2

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 4/20 0.56
GRIN3B O60391 4/20 0.56
GRIN1 Q05586 4/20 0.56
GRIN2A Q12879 4/20 0.56
GRIN2B Q13224 4/20 0.56
GRIN2C Q14957 4/20 0.56
GRIN3A Q8TCU5 4/20 0.56
EPHX2 P34913 6/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA9 Q16790 1/20 0.41
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
ALDH1A1 P00352 2/20 0.37
PKM P14618 1/20 0.37
TSHR P16473 1/20 0.37
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 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
SCHEMBL891670 0.84 GRIN2D (0.60) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL5251164 0.82 GRIN2D (0.61) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL11697939 0.82 GRIN2D (0.68) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL8413718 0.80 GRIN2D (0.59) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL58465 0.80 GRIN2D (0.59) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL140991 0.77 GRIN2D (0.52) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL10957944 0.77 GRIN2D (0.76) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL10787067 0.74 GRIN2D (0.31) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL27567153 0.74 EPHX2 (0.47) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL919012 0.74 MEN1 (0.51) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115443293-A Composition for encapsulating organic light emitting element and organic light emitting display device comprising same 索路思高新材料有限公司 2022-12-06 CN claimed
EP-3849992-A1 CD73 INHIBITORS AND PHARMACEUTICAL USES THEREOF Risen (Suzhou) Pharma Tech Co., Ltd. (CN) 2021-07-21 EP claimed
WO-2020051686-A1 CD73 INHIBITORS AND PHARMACEUTICAL USES THEREOF RISEN (SUZHOU) PHARMA TECH CO. LTD. (CN) 2020-03-19 WO claimed
US-8901155-B2 Method for treating a TRPV1-mediated disease SANTEN PHARMACEUTICAL CO., LTD. (JP) 2014-12-02 US claimed
EP-2666767-A1 Therapeutic agent for TRPV1-mediated disease SANTEN PHARMACEUTICAL CO., LTD. (JP) 2013-11-27 EP claimed
EP-2210878-B1 THERAPEUTIC AGENT FOR OVERACTIVE BLADDER SANTEN PHARMACEUTICAL CO LTD (JP) 2013-07-31 EP claimed
CN-101827816-B Therapeutic agent for TRPV1-mediated disease SANTEN PHARMACEUTICAL CO LTD 2013-05-08 CN claimed
US-20130090359-A1 METHOD FOR TREATING A TRPV1-MEDIATED DISEASE SANTEN PHARMACEUTICAL CO., LTD. (JP) 2013-04-11 US claimed
US-20100261911-A1 THERAPEUTIC AGENT FOR TRPV1-MEDIATED DISEASE SANTEN PHARMACEUTICAL CO., LTD. (JP) 2010-10-14 US claimed
CN-101827816-A Therapeutic agent for TRPV1-mediated disease SANTEN PHARMACEUTICAL CO LTD 2010-09-08 CN claimed
EP-0882023-B1 HISTAMINE H 3 RECEPTOR LIGANDS BLACK JAMES FOUNDATION (GB) 2003-06-04 EP claimed
EP-0812205-B1 ANTITHROMBOTIC AZACYCLOALKYLALKANOYL PEPTIDES AND PSEUDOPEPTIDES RHONE POULENC RORER PHARMA (US) 2001-03-14 EP claimed
EP-1056733-A1 HISTAMINE H3 RECEPTOR LIGANDS JAMES BLACK FOUNDATION LIMITED (GB) 2000-12-06 EP claimed
US-6080871-A ANTIHISTAMINES JAMES BLACK FOUNDATION LIMITED (GB) 2000-06-27 US claimed
WO-1999042458-A1 HISTAMINE H3 RECEPTOR LIGANDS JAMES BLACK FOUNDATION LIMITED (GB) 1999-08-26 WO claimed
CN-1215392-A Histamine H3 receptor ligands BLACK JAMES FOUNDATION (GB) 1999-04-28 CN claimed
EP-0882023-A1 HISTAMINE H 3 RECEPTOR LIGANDS JAMES BLACK FOUNDATION LIMITED (GB) 1998-12-09 EP claimed
WO-1997029092-A1 HISTAMINE H3 RECEPTOR LIGANDS JAMES BLACK FOUNDATION LIMITED (GB) 1997-08-14 WO claimed
EP-0531382-A1 N-SUBSTITUTED-1,2,4-TRIAZOLONE COMPOUNDS FOR TREATMENT OF CARDIOVASCULAR DISORDERS G.D. SEARLE & CO. (US) 1993-03-17 EP claimed
WO-1991018888-A1 N-SUBSTITUTED-1,2,4-TRIAZOLONE COMPOUNDS FOR TREATMENT OF CARDIOVASCULAR DISORDERS G.D. SEARLE & CO. (US) 1991-12-12 WO claimed

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-20100261911-A1 THERAPEUTIC AGENT FOR TRPV1-MEDIATED DISEASE TRPV1, TRPA1, TRPV3 GRIN2D 1943/4885GRIN3B 603/4885GRIN1 378/4885
US-20130090359-A1 METHOD FOR TREATING A TRPV1-MEDIATED DISEASE TRPV1, TRPV3, TRPV2 GRIN2D 752/4885GRIN3B 508/4885GRIN1 294/4885

“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.