SCHEMBL2469256

SCHEMBL2469256

O=C(Cc1ccccc1)NC1CC1

nearest known ligand 0.83

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.83
SIGMAR1 Q99720 10/20 0.71
MEN1 O00255 2/20 0.70
KMT2A Q03164 2/20 0.70
ALDH1A1 P00352 1/20 0.70
LMNA P02545 1/20 0.68
ME3 Q16798 1/20 0.63
OPRM1 P35372 1/20 0.61
OPRL1 P41146 1/20 0.61

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
SCHEMBL5049597 0.92 EPHX2 (0.90) EPHX2SIGMAR1MEN1KMT2AALDH1A1
SCHEMBL2753089 0.92 EPHX2 (0.96) EPHX2SIGMAR1MEN1KMT2AALDH1A1
SCHEMBL8233566 0.91 EPHX2 (0.71) EPHX2SIGMAR1MEN1KMT2AALDH1A1
SCHEMBL16545220 0.91 EPHX2 (0.71) EPHX2SIGMAR1MEN1KMT2AALDH1A1
SCHEMBL30590228 0.91 EPHX2 (0.71) EPHX2SIGMAR1MEN1KMT2AALDH1A1
SCHEMBL5051924 0.91 EPHX2 (1.00) EPHX2SIGMAR1MEN1KMT2AALDH1A1
SCHEMBL3397254 0.91 EPHX2 (1.00) EPHX2SIGMAR1MEN1KMT2AALDH1A1
Hydrochloric Acid SCHEMBL5047929 0.91 EPHX2 (0.93) EPHX2SIGMAR1MEN1KMT2AALDH1A1
SCHEMBL9776408 0.89 EPHX2 (0.73) EPHX2SIGMAR1MEN1KMT2AALDH1A1
SCHEMBL4693545 0.88 EPHX2 (0.71) EPHX2SIGMAR1MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1501830-B1 7-ARYL-3,9-DIAZABICYCLO[3.3.1]NON-6-ENE DERIVATIVES AND THEIR USE AS RENIN INHIBITORS IN THE TREATMENT OF HYPERTENSION, CARDIOVASCULAR OR RENAL DISEASES ACTELION PHARMACEUTICALS LTD (CH) 2011-10-05 EP claimed
US-20240383863-A1 PREPARATION METHOD FOR PYRIMIDINE-2-AMINE INSTITUTE FOR BASIC SCIENCE (KR) 2024-11-21 US disclosed
WO-2023043292-A1 PREPARATION METHOD FOR PYRIMIDINE-2-AMINE 기초과학연구원 2023-03-23 WO disclosed
US-20190077824-A1 N-ALKYL 2-(DISUBSTITUTED)ALKYNYLADENOSINE-5-URONAMIDES AS A2A AGONISTS LEWIS AND CLARK PHARMACEUTICALS INC 2019-03-14 US disclosed
US-20190077824-A1 N-ALKYL 2-(DISUBSTITUTED)ALKYNYLADENOSINE-5-URONAMIDES AS A2A AGONISTS LEWIS AND CLARK PHARMACEUTICALS INC 2019-03-14 US disclosed
US-9822141-B2 N-alkyl 2-(disubstituted)alkynyladenosine-5-uronamides as A2A agonists LEWIS AND CLARK PHARMACEUTICALS, INC. (US) 2017-11-21 US disclosed
US-9822141-B2 N-alkyl 2-(disubstituted)alkynyladenosine-5-uronamides as A2A agonists LEWIS AND CLARK PHARMACEUTICALS, INC. (US) 2017-11-21 US disclosed
US-9822141-B2 N-alkyl 2-(disubstituted)alkynyladenosine-5-uronamides as A2A agonists LEWIS AND CLARK PHARMACEUTICALS, INC. (US) 2017-11-21 US disclosed
US-20170283452-A9 N-ALKYL 2-(DISUBSTITUTED)ALKYNYLADENOSINE-5-URONAMIDES AS A2A AGONISTS LEWIS AND CLARK PHARMACEUTICALS, INC. 2017-10-05 US disclosed
US-20170283452-A9 N-ALKYL 2-(DISUBSTITUTED)ALKYNYLADENOSINE-5-URONAMIDES AS A2A AGONISTS LEWIS AND CLARK PHARMACEUTICALS, INC. 2017-10-05 US disclosed
US-9067963-B2 N-alkyl 2-(disubstituted)alkynyladenosine-5-uronamides as A2A agonists Lewis and Clark Pharmaceuticals, LLC (US) 2015-06-30 US disclosed
EP-2879683-A1 N-ALKYL 2-(DISUBSTITUTED)ALKYNYLADENOSINE-5-URONAMIDES AS A2A AGONISTS Lewis and Clark Pharmaceuticals, Inc. (US) 2015-06-10 EP disclosed
CN-104582709-A N-alkyl 2-(disubstituted)alkynyladenosine-5-uronamides as A2A agonists LEWIS AND CLARK PHARMACEUTICALS INC 2015-04-29 CN disclosed
US-20140037538-A1 N-ALKYL 2-(DISUBSTITUTED)ALKYNYLADENOSINE-5-URONAMIDES AS A2A AGONISTS LEWIS AND CLARK PHARMACEUTICALS, INC. 2014-02-06 US disclosed
US-20140037538-A1 N-ALKYL 2-(DISUBSTITUTED)ALKYNYLADENOSINE-5-URONAMIDES AS A2A AGONISTS LEWIS AND CLARK PHARMACEUTICALS, INC. 2014-02-06 US disclosed
US-20140037538-A1 N-ALKYL 2-(DISUBSTITUTED)ALKYNYLADENOSINE-5-URONAMIDES AS A2A AGONISTS LEWIS AND CLARK PHARMACEUTICALS, INC. 2014-02-06 US disclosed
WO-2014022577-A1 N-ALKYL 2-(DISUBSTITUTED)ALKYNYLADENOSINE-5-URONAMIDES AS A2A AGONISTS LEWIS AND CLARK PHARMACEUTICALS, INC. (US) 2014-02-06 WO disclosed
US-20090069320-A1 Substituted 4-Amino-Quinazoline Compounds with Metabotropic Glutamate Receptor Regulating Activity and Uses Thereof GRUENENTHAL GMBH (DE) 2009-03-12 US disclosed
US-5864043-A CARDIOVASCULAR DISORDERS AND ANGIOTENSIN ANTAGONIST KARL THOMAE GMBH (DE) 1999-01-26 US disclosed
US-5541229-A ANGIOITENSIN II ANTAGONIST AS HYPOTENSIVE AGENTS, ANTIISCHEMIC AGENTS AND CARDIOVASCULAR DISORDERS DR. KARL THOMAE GMBH (DE) 1996-07-30 US 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 (5 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-20240383863-A1 PREPARATION METHOD FOR PYRIMIDINE-2-AMINE NUDT1, UMPS, DPYD EPHX2 1084/4885SIGMAR1 4256/4885MEN1 1037/4885
US-20170283452-A9 N-ALKYL 2-(DISUBSTITUTED)ALKYNYLADENOSINE-5-URONAMIDES AS A2A AGONISTS ADORA2A, ADORA3, ADORA1 EPHX2 969/4885SIGMAR1 757/4885MEN1 3658/4885
US-20140037538-A1 N-ALKYL 2-(DISUBSTITUTED)ALKYNYLADENOSINE-5-URONAMIDES AS A2A AGONISTS ADORA2A, ADORA3, ADORA1 EPHX2 969/4885SIGMAR1 757/4885MEN1 3658/4885
US-20190077824-A1 N-ALKYL 2-(DISUBSTITUTED)ALKYNYLADENOSINE-5-URONAMIDES AS A2A AGONISTS ADORA2A, ADORA3, ADORA1 EPHX2 969/4885SIGMAR1 757/4885MEN1 3658/4885
US-20090069320-A1 Substituted 4-Amino-Quinazoline Compounds with Metabotropic Glutamate Receptor Regulating Activity and Uses Thereof GRM1, GRIN1, GRM2 EPHX2 3812/4885SIGMAR1 468/4885MEN1 4274/4885

“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.