SCHEMBL966655

SCHEMBL966655

CCNC(=O)NC1CCCCC1

nearest known ligand 0.72

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 17/20 0.72
KDM4E B2RXH2 2/20 0.72
ALDH1A1 P00352 2/20 0.72
EPHX2 P34913 4/20 0.64
NPC1 O15118 1/20 0.64
RAB9A P51151 1/20 0.64
SMN1; SMN2 Q16637 1/20 0.64
CYP3A4 P08684 1/20 0.64

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
SCHEMBL13480574 1.00 EPHX1 (0.72) EPHX1KDM4EALDH1A1EPHX2NPC1
SCHEMBL13480593 1.00 EPHX1 (0.72) EPHX1KDM4EALDH1A1EPHX2NPC1
SCHEMBL965080 0.98 EPHX1 (0.69) EPHX1KDM4EALDH1A1EPHX2NPC1
SCHEMBL968340 0.94 EPHX1 (0.63) EPHX1KDM4EALDH1A1EPHX2
SCHEMBL965926 0.89
SCHEMBL15263332 0.89 EPHX1 (0.57) EPHX1KDM4EALDH1A1EPHX2
SCHEMBL6357682 0.84 EPHX1 (1.00) EPHX1KDM4EALDH1A1EPHX2
SCHEMBL12196028 0.84 EPHX1 (1.00) EPHX1KDM4EALDH1A1EPHX2
SCHEMBL13062891 0.82 SMN1; SMN2 (0.68) EPHX1KDM4EALDH1A1EPHX2NPC1
SCHEMBL2751260 0.82 EPHX1 (0.96) EPHX1KDM4EALDH1A1EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023091554-A9 NOVEL HETEROARYL-UREA COMPOUNDS AS KV7.2 INHIBITORS ICAGEN, LLC (US) 2024-05-23 WO disclosed
US-11649214-B2 Inhibitors of the notch transcriptional activation complex kinase (“NACK”) and methods for use of the same UNIVERSITY OF MIAMI (US) 2023-05-16 US disclosed
US-20210171469-A1 INHIBITORS OF THE NOTCH TRANSCRIPTIONAL ACTIVATION COMPLEX KINASE (\"NACK\") AND METHODS FOR USE OF THE SAME UNIVERSITY OF MIAMI 2021-06-10 US disclosed
US-10322118-B2 Compounds and methods for inhibiting Cif virulence factor TRUSTEES OF DARTMOUTH COLLEGE (US) 2019-06-18 US disclosed
EP-2426108-B1 Processes and intermediates for preparing fused heterocyclic kinase inhibitors METHYLGENE INC (CA) 2016-08-10 EP disclosed
US-20160206605-A1 COMPOUNDS AND METHODS FOR INHIBITING CIF VIRULENCE FACTOR NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-07-21 US disclosed
US-20160206605-A1 COMPOUNDS AND METHODS FOR INHIBITING CIF VIRULENCE FACTOR NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-07-21 US disclosed
US-9018378-B2 Processes and intermediates for preparing fused heterocyclic kinase inhibitors METHYLGENE INC. (CA) 2015-04-28 US disclosed
US-20150045389-A1 COMPOUNDS AND METHODS FOR INHIBITING CIF VIRULENCE FACTOR NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-02-12 US disclosed
US-20150045389-A1 COMPOUNDS AND METHODS FOR INHIBITING CIF VIRULENCE FACTOR NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-02-12 US disclosed
US-5614519-A (1-(2,3 or 4-N-morpholinoalkyl)-imidazol-4-yl)-benizimidazol-1-yl-methyl]-biphenyls useful as angiotensin-II antagonists KARL THOMAE GMBH (DE) 1997-03-25 US disclosed
US-5602127-A ADMINISTERING TO TREAT HYPERTENSION KARL THOMAE GMBH (DE) 1997-02-11 US disclosed
US-5594003-A HYPOTENSIVE AGENTS DR. KARL THOMAE GMBH (DE) 1997-01-14 US disclosed
US-5591762-A HYPOTENSIVE AGENTS DR. KARL THOMAE GMBH (DE) 1997-01-07 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
US-5459147-A Angeotensin-antagonistic effects; hypotensive, antiischemic, and antidiabetic agents, treating glaucoma DR. KARL THOMAE GMBH (DE) 1995-10-17 US disclosed
EP-0083096-B1 PRODUCTION OF URETHANE COMPOUNDS Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1987-02-25 EP disclosed
US-4621149-A PLATINUM GROUP METAL HALOGEN OR HALOGEN COMPOUND ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1986-11-04 US disclosed
EP-0083096-A2 Production of urethane compounds Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1983-07-06 EP disclosed
US-4056527-A HERBICIDE BAYER AKTIENGESELLSCHAFT (DT) 1977-11-01 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-20210171469-A1 INHIBITORS OF THE NOTCH TRANSCRIPTIONAL ACTIVATION COMPLEX KINASE (\"NACK\") AND METHODS FOR USE OF THE SAME CHUK, NOTCH1, NUAK1 EPHX1 4113/4885KDM4E 1027/4885ALDH1A1 3741/4885
US-20160206605-A1 COMPOUNDS AND METHODS FOR INHIBITING CIF VIRULENCE FACTOR CFTR, NCF1, CFB EPHX1 1831/4885KDM4E 4728/4885ALDH1A1 3655/4885
US-10322118-B2 Compounds and methods for inhibiting Cif virulence factor CFTR, NCF1, CFB EPHX1 1831/4885KDM4E 4728/4885ALDH1A1 3655/4885
US-20150045389-A1 COMPOUNDS AND METHODS FOR INHIBITING CIF VIRULENCE FACTOR CFTR, NCF1, CFB EPHX1 1764/4885KDM4E 4727/4885ALDH1A1 3767/4885
US-11649214-B2 Inhibitors of the notch transcriptional activation complex kinase (“NACK”) and methods for use of the same NOTCH1, CHUK, CBFB EPHX1 3729/4885KDM4E 916/4885ALDH1A1 3517/4885

“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.