SCHEMBL6401640

SCHEMBL6401640

CCCC1C[N]C(CCC)CC(CCC)C1

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 8/20 0.39
NOS1 P29475 8/20 0.39
NOS2 P35228 8/20 0.39

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
SCHEMBL16444953 0.75 NOS3 (0.39) NOS3NOS1NOS2
SCHEMBL19125511 0.75 NOS3 (0.39) NOS3NOS1NOS2
SCHEMBL11158769 0.74 NOS3 (0.41) NOS3NOS1NOS2
SCHEMBL4859077 0.74 NOS3 (0.41) NOS3NOS1NOS2
SCHEMBL19125592 0.68 NOS3 (0.34) NOS3NOS1NOS2
SCHEMBL28446064 0.68
SCHEMBL28287947 0.65 CYP1A2 (0.38) NOS3NOS1NOS2
SCHEMBL21187207 0.64
SCHEMBL13785114 0.64
SCHEMBL910738 0.63

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0494005-B1 Multicomponent agent or kit for the preparation of the sulphoconjugated forms of pyridino-, pyrimidino- or triazino-N-oxyde compounds and method of application thereof OREAL (FR) 1997-02-05 EP claimed
US-20050049232-A1 Composition LINDAU PAR (SE) 2005-03-03 US disclosed
EP-1463483-A1 NEW COMPOSITION Ponsus Pharma AB (SE) 2004-10-06 EP disclosed
WO-2003055454-A1 NEW COMPOSITION PONSUS PHARMA AB (SE) 2003-07-10 WO disclosed
US-5360804-A STABILITY L'OREAL (FR) 1994-11-01 US disclosed
US-4393065-A INCREASED PRODUCTIVITY OF BY-PRODUCTS BY INCLUSION OF PYRIMIDINE COMPOUNDS THE UPJOHN COMPANY (US) 1983-07-12 US disclosed
US-4316901-A Animal feed and process THE UPJOHN COMPANY (US) 1982-02-23 US disclosed
US-4315930-A A DIAMINO-TRIAZINE-3-OXIDE THE UPJOHN COMPANY (US) 1982-02-16 US disclosed
EP-0042669-A2 Compounds and compositions for use in animal feeds THE UPJOHN COMPANY (US) 1981-12-30 EP disclosed
US-4308271-A PYRIMIDINE OXIDE DERIVATIVES TO INCREASE PRODUCTION THE UPJOHN COMPANY (US) 1981-12-29 US disclosed
US-4307093-A INCREASING PRODUCTION USING OXATRIAZINES THE UPJOHN COMPANY (US) 1981-12-22 US disclosed
US-4287338-A Sulfooxy-pyrimidinium, -pyridinium, and -triazinium hydroxide inner salts THE UPJOHN COMPANY (US) 1981-09-01 US disclosed
US-4282228-A Animal feed and process THE UPJOHN COMPANY (US) 1981-08-04 US disclosed
US-4122264-A Pyridine containing morpholines THE UPJOHN COMPANY (US) 1978-10-24 US disclosed
US-4115396-A HYPOTENSIVE AGENTS THE UPJOHN COMPANY (US) 1978-09-19 US disclosed
US-4089672-A HERBICIDES THE UPJOHN COMPANY (US) 1978-05-16 US disclosed
US-4084955-A 1-CARBOXYALKYL-DI- AND TRIHALOPYRAZOLES, HERBICIDES THE UPJOHN COMPANY (US) 1978-04-18 US disclosed
US-4067874-A Novel pyridine 1-oxides THE UPJOHN COMPANY (US) 1978-01-10 US disclosed
US-3995035-A 6-Amino-2-lower-alkyl-4-nitropyridine N-oxide compositions and coccidiostat process THE UPJOHN COMPANY (US) 1976-11-30 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 (1 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-20050049232-A1 Composition CUTA, LIPG, LIPA NOS3 491/4885NOS1 368/4885NOS2 141/4885

“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.