SCHEMBL2736685

SCHEMBL2736685

CCCCNC(=O)C(C)(C)C

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 7/20 0.55
POLB P06746 2/20 0.52
ACHE P22303 8/20 0.48
MMP2 P08253 1/20 0.48
ALDH1A1 P00352 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
TSHR P16473 1/20 0.44
HTT P42858 1/20 0.44

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
SCHEMBL6840451 0.93 EPHX1 (0.64) EPHX1POLBALDH1A1SMN1; SMN2
SCHEMBL5438759 0.91 EPHX1 (0.68) EPHX1POLBALDH1A1SMN1; SMN2
SCHEMBL13701713 0.91 EPHX1 (0.68) EPHX1POLBALDH1A1SMN1; SMN2
SCHEMBL26312872 0.91 EPHX1 (0.68) EPHX1POLBALDH1A1SMN1; SMN2
SCHEMBL5439873 0.91 EPHX1 (0.68) EPHX1POLBALDH1A1SMN1; SMN2
SCHEMBL24376776 0.91 EPHX1 (0.68) EPHX1POLBALDH1A1SMN1; SMN2
SCHEMBL17694454 0.91 EPHX1 (0.68) EPHX1POLBALDH1A1SMN1; SMN2
SCHEMBL19478069 0.91 EPHX1 (0.68) EPHX1POLBALDH1A1SMN1; SMN2
SCHEMBL21738174 0.91 EPHX1 (0.68) EPHX1POLBALDH1A1SMN1; SMN2
SCHEMBL26780351 0.88 CNR1 (0.47) EPHX1POLBACHEMMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11873317-B2 Galectin-3 inhibiting c-glycosides GLYCOMIMETICS, INC. (US) 2024-01-16 US disclosed
US-20230364086-A1 COMBINATION THERAPIES WITH EHMT2 INHIBITORS Epizyme, Inc. 2023-11-16 US disclosed
US-20230348493-A1 COMPOUND FOR ADJUSTING ACTIVITY OF NMDA RECEPTOR, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF BEIJING GREATWAY PHARMACEUTICAL TECHNOLOGY CO. LTD. (CN) 2023-11-02 US disclosed
US-11771715-B2 Circular RNA compositions and methods ORNA THERAPEUTICS, INC. (US) 2023-10-03 US disclosed
US-11766449-B2 Circular RNA compositions and methods ORNA THERAPEUTICS, INC. (US) 2023-09-26 US disclosed
US-20230278958-A1 TRICYCLIC HETEROCYCLES MERCK PATENT GMBH (DE) 2023-09-07 US disclosed
US-11718626-B2 Macrocyclic compounds for treatment of medical disorders ACHILLION PHARMACEUTICALS, INC. (US) 2023-08-08 US disclosed
US-11679120-B2 Circular RNA compositions and methods ORNA THERAPEUTICS, INC. (US) 2023-06-20 US disclosed
US-20230174538-A1 Tricyclic heterocycles MERCK PATENT GMBH (DE) 2023-06-08 US disclosed
US-20230071620-A1 PHARMACEUTICAL COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS ACHILLION PHARMACEUTICALS, INC. 2023-03-09 US disclosed
US-20070299221-A1 Polymerisation Using Chain Transfer Agents UNIVERSITY OF LEEDS, THE (GB) 2007-12-27 US disclosed
US-20070149538-A1 Diarylamine-Containing Compounds and Compositions, and their use as Modulators of C-Kit Receptors IRM LLC (BM) 2007-06-28 US disclosed
US-20070027144-A1 Novel use of cannabinoid receptor agonist SHIONOGI & CO., LTD. (JP) 2007-02-01 US disclosed
US-20070027144-A1 Novel use of cannabinoid receptor agonist SHIONOGI & CO., LTD. (JP) 2007-02-01 US disclosed
WO-2006005725-A2 N CONTAINING CONDENSED HETEROCYCLES WITH ANTITUMOR EFFECTS SPEEDEL EXPERIMENTA AG (CH) 2006-01-19 WO disclosed
US-5827863-A Pyrazole derivatives as angiotensin II antagonists J. URIACH & CIA, S.A. (ES) 1998-10-27 US disclosed
US-5606078-A ANTIHYPERTENSIVE AGENTS CIBA-GEIGY CORPORATION (US) 1997-02-25 US disclosed
EP-0678514-A1 3,5-Disubstituted tetrahydrofuran-2-ones CIBA-GEIGY AG (CH) 1995-10-25 EP disclosed
EP-0369743-B1 Heterocyclic amides ZENECA LTD (GB) 1995-04-19 EP disclosed
EP-0369743-A2 Heterocyclic amides ZENECA LIMITED (GB) 1990-05-23 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 (12 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-20230348493-A1 COMPOUND FOR ADJUSTING ACTIVITY OF NMDA RECEPTOR, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF GRIN1, GRIN3A, GRIN2C EPHX1 2257/4885POLB 3207/4885ACHE 79/4885
US-20070027144-A1 Novel use of cannabinoid receptor agonist CNR2, CNR1, OPRM1 EPHX1 982/4885POLB 1324/4885ACHE 1552/4885
US-20230364086-A1 COMBINATION THERAPIES WITH EHMT2 INHIBITORS EHMT2, BHMT, SHMT2 EPHX1 323/4885POLB 893/4885ACHE 4322/4885
US-11718626-B2 Macrocyclic compounds for treatment of medical disorders CFD, TFPI, CFH EPHX1 1257/4885POLB 2977/4885ACHE 3052/4885
US-11771715-B2 Circular RNA compositions and methods RTCB, HNRNPA1, HNRNPAB EPHX1 4437/4885POLB 984/4885ACHE 4748/4885
US-20230278958-A1 TRICYCLIC HETEROCYCLES YAP1, TERF2IP, TEAD1 EPHX1 3801/4885POLB 1569/4885ACHE 4878/4885
US-20230071620-A1 PHARMACEUTICAL COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS CFD, TFPI, CFH EPHX1 950/4885POLB 2864/4885ACHE 3031/4885
US-11873317-B2 Galectin-3 inhibiting c-glycosides LGALS3, LGALS3BP, LGALS1 EPHX1 4410/4885POLB 4838/4885ACHE 2097/4885
US-20230174538-A1 Tricyclic heterocycles YAP1, TEAD1, TERF2IP EPHX1 3709/4885POLB 1991/4885ACHE 4874/4885
US-20070149538-A1 Diarylamine-Containing Compounds and Compositions, and their use as Modulators of C-Kit Receptors KIT, PRKCH, PRKCE EPHX1 1817/4885POLB 3963/4885ACHE 822/4885
US-11679120-B2 Circular RNA compositions and methods RTCB, HNRNPA1, HNRNPAB EPHX1 4437/4885POLB 984/4885ACHE 4748/4885
US-11766449-B2 Circular RNA compositions and methods RTCB, RNGTT, HNRNPAB EPHX1 4605/4885POLB 899/4885ACHE 4695/4885

“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.