SCHEMBL533767

SCHEMBL533767

Cc1cccc(NC(=O)c2ccccc2C)c1

nearest known ligand 0.81

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KCNK3 O14649 5/20 0.81
KCNK9 Q9NPC2 5/20 0.81
KMT2A Q03164 4/20 0.74
MEN1 O00255 3/20 0.74
ALDH1A1 P00352 2/20 0.74
SMN1; SMN2 Q16637 3/20 0.72
HPGD P15428 1/20 0.72
L3MBTL1 Q9Y468 1/20 0.68
POLB P06746 2/20 0.67
F2R P25116 2/20 0.65
TP53 P04637 1/20 0.63
THRB P10828 1/20 0.63
RXFP1 Q9HBX9 1/20 0.63
PKM P14618 1/20 0.62
RAB9A P51151 1/20 0.62
TYK2 P29597 1/20 0.59

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
SCHEMBL11668137 0.91 KCNK3 (0.84) KCNK3KCNK9KMT2AMEN1ALDH1A1
SCHEMBL3356211 0.85 MEN1 (1.00) KCNK3KCNK9KMT2AMEN1ALDH1A1
SCHEMBL31424193 0.85 MEN1 (0.72) KCNK3KCNK9KMT2AMEN1ALDH1A1
SCHEMBL16941525 0.85 MEN1 (0.72) KCNK3KCNK9KMT2AMEN1ALDH1A1
SCHEMBL259352 0.85 MEN1 (0.72) KCNK3KCNK9KMT2AMEN1ALDH1A1
SCHEMBL11305192 0.85 KCNK3 (0.70) KCNK3KCNK9KMT2AMEN1ALDH1A1
SCHEMBL7181742 0.85 MEN1 (0.71) KCNK3KCNK9KMT2AMEN1ALDH1A1
SCHEMBL14825240 0.84 KCNK3 (0.82) KCNK3KCNK9KMT2AMEN1ALDH1A1
SCHEMBL21993 0.84 HPGD (1.00) KCNK3KCNK9KMT2AMEN1ALDH1A1
SCHEMBL19491367 0.84 HPGD (0.78) KCNK3KCNK9KMT2AMEN1ALDH1A1

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-3395795-B1 MALONONITRILE OXIME ETHER COMPOUND AND USE THEREOF SHENYANG SINOCHEM AGROCHEMICALS R & D CO LTD (CN) 2023-07-19 EP disclosed
US-10301318-B2 Neuroactive compounds and methods of using the same THE GENERAL HOSPITAL CORPORATION (US) 2019-05-28 US disclosed
US-20170247383-A1 NEUROACTIVE COMPOUNDS AND METHODS OF USING THE SAME THE GENERAL HOSPITAL CORPORATION (US) 2017-08-31 US disclosed
EP-2261215-B1 Process for preparing benzazepine compounds or salts thereof OTSUKA PHARMA CO LTD (JP) 2014-12-31 EP disclosed
US-8647528-B2 Water absorbing agent and production method thereof NIPPON SHOKUBAI CO., LTD. (JP) 2014-02-11 US disclosed
US-8501730-B2 Process for preparing benzazepine compounds or salts thereof OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-08-06 US disclosed
US-8273735-B2 Process for preparing benzazepine compounds or salts thereof OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-09-25 US disclosed
US-20120226034-A1 PROCESS FOR PREPARING BENZAZEPINE COMPOUNDS OR SALTS THEREOF OTSUKA PHARMACEUTICAL CO., LTD. 2012-09-06 US disclosed
EP-2251319-B1 Process for preparing derivatives of benzoic acid OTSUKA PHARMA CO LTD (JP) 2012-02-08 EP disclosed
EP-1919874-B1 PROCESS FOR PREPARING BENZAZEPINE COMPOUNDS OR SALTS THEREOF OTSUKA PHARMA CO LTD (JP) 2011-01-26 EP disclosed
EP-2261215-A1 Process for preparing benzazepine compounds or salts thereof Otsuka Pharmaceutical Co., Ltd. (JP) 2010-12-15 EP disclosed
EP-2251319-A2 Process for preparing derivatives of benzoic acid Otsuka Pharmaceutical Co., Ltd. (JP) 2010-11-17 EP disclosed
US-20100270501-A1 Water absorbing agent and production method thereof NIPPON SHOKUBAI CO., LTD. (JP) 2010-10-28 US disclosed
US-20090306369-A1 PROCESS FOR PREPARING BENZAZEPINE COMPOUNDS OR SALTS THEREOF OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2009-12-10 US disclosed
EP-1919874-A2 PROCESS FOR PREPARING BENZAZEPINE COMPOUNDS OR SALTS THEREOF Otsuka Pharmaceutical Company, Limited (JP) 2008-05-14 EP disclosed
WO-2007026971-A2 PROCESS FOR PREPARING BENZAZEPINE COMPOUNDS OR SALTS THEREOF OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-03-08 WO disclosed
CN-1287046-C Method for producing paper and yield-improving agent SEIKO PMC CORP (JP) 2006-11-29 CN disclosed
CN-1643215-A Method for producing paper and yield-improving agent SEIKO PMC CORP (JP) 2005-07-20 CN disclosed
US-4123554-A Fungicidal and germicidal benzanilides KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1978-10-31 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 (4 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-20170247383-A1 NEUROACTIVE COMPOUNDS AND METHODS OF USING THE SAME GAP43, PNMT, SLC6A3 KCNK3 672/4885KCNK9 2152/4885KMT2A 492/4885
US-20090306369-A1 PROCESS FOR PREPARING BENZAZEPINE COMPOUNDS OR SALTS THEREOF AVPR2, AVPR1B, AVPR1A KCNK3 393/4885KCNK9 292/4885KMT2A 1587/4885
US-20120226034-A1 PROCESS FOR PREPARING BENZAZEPINE COMPOUNDS OR SALTS THEREOF AVPR2, AVPR1B, AVPR1A KCNK3 393/4885KCNK9 292/4885KMT2A 1587/4885
US-10301318-B2 Neuroactive compounds and methods of using the same GAP43, PNMT, SLC6A3 KCNK3 672/4885KCNK9 2152/4885KMT2A 492/4885

“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.