SCHEMBL114012

SCHEMBL114012

Cn1ccnc1OC=O

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL13665505 0.79
SCHEMBL17395241 0.76 KMT2A (0.40)
SCHEMBL20195592 0.76
SCHEMBL17395232 0.75 ALDH1A1 (0.34)
SCHEMBL2960713 0.73 ALDH1A1 (0.53)
SCHEMBL2516063 0.73
SCHEMBL15286667 0.71
SCHEMBL27349359 0.71 CHRNB2 (0.41)
SCHEMBL1682094 0.71 CHRNB2 (0.41)
SCHEMBL2513335 0.70

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
CN-102534576-B Plating catalyst and method ROHM & HAAS ELECT MAT 2015-03-04 CN claimed
CN-118165639-B Wear-resistant lubricating oil coating material for mechanical bearing and preparation method thereof 西安大力马能源科技有限公司 2024-09-03 CN disclosed
CN-118165639-A Wear-resistant lubricating oil coating material for mechanical bearing and preparation method thereof 西安大力马能源科技有限公司 2024-06-11 CN disclosed
EP-3164527-A1 SYNTHESIS AND USE OF BIO-BASED IMIDAZOLIUM CARBOXYLATES Université de Bourgogne (FR) 2017-05-10 EP disclosed
WO-2016001436-A1 SYNTHESIS AND USE OF BIO-BASED IMIDAZOLIUM CARBOXYLATES Université de Bourgogne (FR) 2016-01-07 WO disclosed
CN-102534576-B Plating catalyst and method ROHM & HAAS ELECT MAT 2015-03-04 CN disclosed
US-8674020-B2 Process for preparing polyamides UNIVERSITY OF LEICESTER (GB) 2014-03-18 US disclosed
CN-102534576-A Plating catalyst and method ROHM & HAAS ELECT MAT 2012-07-04 CN disclosed
US-20120130017-A1 PROCESS AND NEW COMPOUNDS UNIVERSITY OF LEICESTER (GB) 2012-05-24 US disclosed
EP-2424921-A2 NEW PROCESS AND NEW COMPOUNDS University Of Leicester (GB) 2012-03-07 EP disclosed
WO-2010125382-A2 NEW PROCESS AND NEW COMPOUNDS UNIVERSITY OF LEICESTER (GB) 2010-11-04 WO disclosed
CN-1058490-C Tetrazolinone derivatives BAYER AGROCHEM KK (JP) 2000-11-15 CN disclosed
CN-1223115-A Pharmaceutical composition containing quinoline and quinazoline derivatives and novel compounds therefor TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1999-07-21 CN disclosed
CN-1122333-A Tetrazolinone derivatives BAYER AGROCHEM KK (JP) 1996-05-15 CN disclosed