SCHEMBL7784142

SCHEMBL7784142

C=CCC1CCCCC[N]1

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NOS2 P35228 6/20 0.47
NOS1 P29475 5/20 0.47
NOS3 P29474 3/20 0.47

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
SCHEMBL278247 0.98
SCHEMBL1389076 0.91
SCHEMBL5524836 0.79
SCHEMBL6903892 0.76
SCHEMBL4749067 0.72 NOS1 (0.32) NOS2NOS1NOS3
SCHEMBL11221727 0.70 NOS3 (0.38) NOS2NOS1NOS3
SCHEMBL11877100 0.70
SCHEMBL1547627 0.70
SCHEMBL988329 0.69 NOS3 (0.33) NOS2NOS1NOS3
SCHEMBL4059958 0.68 NOS1 (0.48) NOS2NOS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1140892-A1 PHOTOCHROMIC SUBSTIITUTED 2H-NAPHTHO[1,2-B]PYRANS JAMES ROBINSON LIMITED (GB) 2001-10-10 EP claimed
US-6232312-B1 ADMINISTERING A COMBINATION OF INDENE AND PYRIMIDO(5,4-D)PYRIMIDINE DERIVATIVES TO TREAT PREPANCREATIC CANCER CELL PATHWAYS, INC. 2001-05-15 US claimed
WO-2000035902-A1 PHOTOCHROMIC SUBSTITUTED 2H-NAPHTHO[1,2-b]PYRANS JAMES ROBINSON LIMITED (GB) 2000-06-22 WO claimed
EP-0338507-A2 Use of mabuterol and related compounds for intraocular pressure adjustment Basotherm GmbH (DE) 1989-10-25 EP claimed
US-4055712-A CONDENSATION OF A TERTIARY AMINE WITH 1,4-DIHALO-2-BUTENE, QUATERNIZATION KAWANEE INDUSTRIES (US) 1977-10-25 US claimed
US-4036959-A CATIONIC POLYAMINES MILLMASTER ONYX CORPORATION (US) 1977-07-19 US claimed
US-20180015090-A1 COMPOUNDS FOR ENHANCING PPARy EXPRESSION AND NUCLEAR TRANSLOCATION AND THERAPEUTIC USE THEREOF REALINN LIFE SCIENCE LIMITED (TW) 2018-01-18 US disclosed
EP-3250201-A1 COMPOUNDS FOR ENHANCING PPAR EXPRESSION AND NUCLEAR TRANSLOCATION AND THERAPEUTIC USE THEREOF Realinn Life Science Limited (TW) 2017-12-06 EP disclosed
WO-2016119701-A1 COMPOUNDS FOR ENHANCING PPARγ EXPRESSION AND NUCLEAR TRANSLOCATION AND THERAPEUTIC USE THEREOF REALINN LIFE SCIENCE LIMITED (TW) 2016-08-04 WO disclosed
EP-1140892-A1 PHOTOCHROMIC SUBSTIITUTED 2H-NAPHTHO[1,2-B]PYRANS JAMES ROBINSON LIMITED (GB) 2001-10-10 EP disclosed
EP-1140892-A1 PHOTOCHROMIC SUBSTIITUTED 2H-NAPHTHO[1,2-B]PYRANS JAMES ROBINSON LIMITED (GB) 2001-10-10 EP disclosed
US-6232312-B1 ADMINISTERING A COMBINATION OF INDENE AND PYRIMIDO(5,4-D)PYRIMIDINE DERIVATIVES TO TREAT PREPANCREATIC CANCER CELL PATHWAYS, INC. 2001-05-15 US disclosed
WO-2000035902-A1 PHOTOCHROMIC SUBSTITUTED 2H-NAPHTHO[1,2-b]PYRANS JAMES ROBINSON LIMITED (GB) 2000-06-22 WO disclosed
EP-0338507-A2 Use of mabuterol and related compounds for intraocular pressure adjustment Basotherm GmbH (DE) 1989-10-25 EP disclosed
EP-0338507-A2 Use of mabuterol and related compounds for intraocular pressure adjustment Basotherm GmbH (DE) 1989-10-25 EP disclosed
US-4055712-A CONDENSATION OF A TERTIARY AMINE WITH 1,4-DIHALO-2-BUTENE, QUATERNIZATION KAWANEE INDUSTRIES (US) 1977-10-25 US disclosed
US-4036959-A CATIONIC POLYAMINES MILLMASTER ONYX CORPORATION (US) 1977-07-19 US disclosed
US-4012446-A 1,4-DIHALO-2-BUTENE MILLMASTER ONYX CORPORATION (US) 1977-03-15 US disclosed
US-4001432-A FROM 1,4-DIHALO-2-BUTENE, TERTIARY DIAMINE, AND TERTIARY MONOAMINE MILLMASTER ONYX CORPORATION (US) 1977-01-04 US disclosed
US-3931319-A QUATERNARY AMMONIUM ADDITION POLYMERS, MICROBIOCIDES MILLMASTER ONYX CORPORATION (US) 1976-01-06 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-20180015090-A1 COMPOUNDS FOR ENHANCING PPARy EXPRESSION AND NUCLEAR TRANSLOCATION AND THERAPEUTIC USE THEREOF PPARA, PPARD, PPARG NOS2 3718/4885NOS1 3951/4885NOS3 3230/4885

“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.