SCHEMBL1301624

SCHEMBL1301624

OCC/C=C\c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAM P19021 1/20 0.54
SIGMAR1 Q99720 2/20 0.48
IDO1 P14902 2/20 0.48
MAOB P27338 2/20 0.46
HTR2A P28223 3/20 0.45
HDAC3 O15379 1/20 0.43
TNKS O95271 1/20 0.43
HDAC4 P56524 1/20 0.43
HDAC1 Q13547 1/20 0.43
HCAR2 Q8TDS4 1/20 0.43
HDAC7 Q8WUI4 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC10 Q969S8 1/20 0.43
HDAC11 Q96DB2 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
TNKS2 Q9H2K2 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
HDAC9 Q9UKV0 1/20 0.43
HDAC5 Q9UQL6 1/20 0.43
PLIN1 O60240 1/20 0.43

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
SCHEMBL1301627 1.00 PAM (0.54) PAMSIGMAR1IDO1MAOBHTR2A
SCHEMBL4171733 1.00 PAM (0.54) PAMSIGMAR1IDO1MAOBHTR2A
SCHEMBL11884294 0.87 CA1 (0.50) PAMSIGMAR1HDAC3HDAC4HDAC1
SCHEMBL11879177 0.87 CA1 (0.50) PAMSIGMAR1HDAC3HDAC4HDAC1
SCHEMBL6043189 0.87 PAM (0.47) PAMSIGMAR1MAOBHTR2AHDAC3
SCHEMBL5470592 0.86 PAM (0.50) PAMSIGMAR1IDO1MAOBHTR2A
SCHEMBL5470587 0.86 PAM (0.50) PAMSIGMAR1IDO1MAOBHTR2A
SCHEMBL7939387 0.85 IDO1 (0.56) PAMSIGMAR1IDO1MAOBHTR2A
SCHEMBL7568412 0.85 IDO1 (0.56) PAMSIGMAR1IDO1MAOBHTR2A
SCHEMBL10430031 0.85 IDO1 (0.56) PAMSIGMAR1IDO1MAOBHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-56140905-A None JP disclosed
US-9828338-B2 Carbamate derivatives of lactam based N-acylethanolamine acid amidase (NAAA) inhibitors THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-11-28 US disclosed
US-20160068482-A1 CARBAMATE DERIVATIVES OF LACTAM BASED N-ACYLETHANOLAMINE ACID AMIDASE (NAAA) INHIBITORS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2016-03-10 US disclosed
WO-2015128428-A1 PHEROMONE DISPENSER MADE OF PLASTIC MATERIAL BASF SE (DE) 2015-09-03 WO disclosed
WO-2014144836-A2 CARBAMATE DERIVATIVES OF LACTAM BASED N-ACYLETHANOLAMINE ACID AMIDASE (NAAA) INHIBITORS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-09-18 WO disclosed
EP-2384111-A1 PHEROMONE DISPENSER BASF SE (DE) 2011-11-09 EP disclosed
US-20110266361-A1 PHEROMONE DISPENSER BASF SE (DE) 2011-11-03 US disclosed
WO-2010076316-A1 PHEROMONE DISPENSER BASF SE (DE) 2010-07-08 WO disclosed
US-6352703-B1 APPLYING POISON AND FEEDING STIMULANT COMPRISING NAPHTHALENE, 2,6-DI-TERT-BUTYL-4-METHYLPHENOL, ERGOSTEROL, DIOCTYL ADIPATE, AND/OR DIOCTYL PHTHALATE; INCREASED CONSUMPTION BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE 2002-03-05 US disclosed
WO-1999029172-A1 COMPOSITIONS AND METHODS FOR DETECTING AND KILLING TERMITES BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITYAND AGRICULTURAL AND MECHANICAL COLLEGE (US) 1999-06-17 WO disclosed
US-5874097-A ANALYZING AIR SAMPLES NEAR OR IN BUILDINGS FOR THE PRESENCE OF A REPORTER MOLECULE, PREFERABLY NAPHTHALENE, TO INDICATE THE PRESENCE OF A TERMITE NEST BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE (US) 1999-02-23 US disclosed
US-5637298-A TOXICANT AND 2-NAPHTHALENEMETHANOL AS ATTRACTANT BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE (US) 1997-06-10 US disclosed
US-4990505-A Treating asthma, bronchitis; adrenergic stimulants GLAXO GROUP LIMITED (GB) 1991-02-05 US disclosed
JP-S56140905-A TERMITE-KILLING AGENT COMPOSITION NIPPON ZEON CO LTD 1981-11-04 JP 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-20160068482-A1 CARBAMATE DERIVATIVES OF LACTAM BASED N-ACYLETHANOLAMINE ACID AMIDASE (NAAA) INHIBITORS NAAA, FAAH, FAAH2 PAM 78/4885SIGMAR1 1458/4885IDO1 1234/4885

“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.