SCHEMBL2756

SCHEMBL2756

CC[CH]C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 5/20 0.40
GRIN3B O60391 5/20 0.40
GRIN1 Q05586 5/20 0.40
GRIN2A Q12879 5/20 0.40
GRIN2B Q13224 5/20 0.40
GRIN2C Q14957 5/20 0.40
GRIN3A Q8TCU5 5/20 0.40
NPFFR1 Q9GZQ6 1/20 0.34
NPFFR2 Q9Y5X5 1/20 0.34
SLC22A2 O15244 2/20 0.33
SLC47A1 Q96FL8 2/20 0.33
LMNA P02545 2/20 0.33
SLC22A1 O15245 1/20 0.33
TSHR P16473 1/20 0.33
NFKB1 P19838 1/20 0.33
STAT6 P42226 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
HSD17B10 Q99714 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
POLB P06746 1/20 0.32

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
SCHEMBL891669 0.80 KMT2A (0.39) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL7404499 0.77 EPHX2 (0.37) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL891885 0.75
SCHEMBL6756192 0.75 FAAH (0.41) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL27740241 0.74 NPFFR1 (0.39) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL28089950 0.74 GRIN2D (0.46) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
Hydrochloric Acid SCHEMBL27921465 0.72 GRIN2D (0.44) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL140990 0.69 GRIN2D (0.39) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL16354052 0.69
SCHEMBL892469 0.68

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11530234-B2 CD73 inhibitors and pharmaceutical uses thereof Risen (Suzhou) Pharma Tech Co., Ltd. (CN) 2022-12-20 US claimed
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
US-20210139526-A1 CD73 INHIBITORS AND PHARMACEUTICAL USES THEREOF RISEN (SUZHOU) PHARMA TECH Co.,Ltd. (CN) 2021-05-13 US claimed
CN-112771061-A CD73 inhibitor and pharmaceutical application thereof 润佳(苏州)医药科技有限公司 2021-05-07 CN claimed
US-10881681-B2 CD73 inhibitors and pharmaceutical uses thereof Risen (Suzhou) Pharma Tech Co., Ltd. (CN) 2021-01-05 US claimed
WO-2020051686-A1 CD73 INHIBITORS AND PHARMACEUTICAL USES THEREOF RISEN (SUZHOU) PHARMA TECH CO. LTD. (CN) 2020-03-19 WO claimed
CN-110885352-A CD73 inhibitor and pharmaceutical application thereof 润佳(苏州)医药科技有限公司 2020-03-17 CN claimed
US-20200078388-A1 CD73 INHIBITORS AND PHARMACEUTICAL USES THEREOF RISEN (SUZHOU) PHARMA TECH CO, LTD. (CN) 2020-03-12 US claimed
US-8901155-B2 Method for treating a TRPV1-mediated disease SANTEN PHARMACEUTICAL CO., LTD. (JP) 2014-12-02 US 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
EP-2210878-A1 THERAPEUTIC AGENT FOR TRPV1-MEDIATED DISEASE Santen Pharmaceutical Co., Ltd (JP) 2010-07-28 EP claimed
WO-2008009963-A2 PYRIMIDINE DERIVATIVES AS MODULATORS OF PARATHYROID HORMONE RECEPTORS JAMES BLACK FOUNDATION LIMITED (GB) 2008-01-24 WO claimed
EP-0882023-B1 HISTAMINE H 3 RECEPTOR LIGANDS BLACK JAMES FOUNDATION (GB) 2003-06-04 EP claimed
US-6080871-A ANTIHISTAMINES JAMES BLACK FOUNDATION LIMITED (GB) 2000-06-27 US 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 (6 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-20200078388-A1 CD73 INHIBITORS AND PHARMACEUTICAL USES THEREOF ENTPD5, ENTPD1, NT5E GRIN2D 4128/4885GRIN3B 2853/4885GRIN1 2629/4885
US-10881681-B2 CD73 inhibitors and pharmaceutical uses thereof ENTPD5, ENTPD1, NT5E GRIN2D 4128/4885GRIN3B 2853/4885GRIN1 2629/4885
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
US-11530234-B2 CD73 inhibitors and pharmaceutical uses thereof ENTPD5, ENTPD1, NT5E GRIN2D 4128/4885GRIN3B 2853/4885GRIN1 2629/4885
US-20210139526-A1 CD73 INHIBITORS AND PHARMACEUTICAL USES THEREOF ENTPD5, ENTPD1, NT5E GRIN2D 4128/4885GRIN3B 2853/4885GRIN1 2629/4885

“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.