SCHEMBL723876

SCHEMBL723876

O=C1CCCC(=O)N1C1CCCCC1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
CYP2C9 P11712 3/20 0.47
CYP2C19 P33261 3/20 0.47
CYP3A4 P08684 1/20 0.47
KMT2A Q03164 1/20 0.47
OPRM1 P35372 2/20 0.44
OPRK1 P41145 2/20 0.44
OPRL1 P41146 2/20 0.44
LMNA P02545 2/20 0.41
POLB P06746 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.40
ALOX15 P16050 1/20 0.40
HTT P42858 1/20 0.40
CREBBP Q92793 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TSHR P16473 2/20 0.39
NPSR1 Q6W5P4 1/20 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
SCHEMBL20858667 1.00 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2CYP2C9CYP2C19CYP3A4
SCHEMBL23841245 1.00 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2CYP2C9CYP2C19CYP3A4
SCHEMBL1950441 0.92 OPRM1 (0.49) ALDH1A1SMN1; SMN2CYP2C9CYP2C19CYP3A4
SCHEMBL20858630 0.92 OPRM1 (0.49) ALDH1A1SMN1; SMN2CYP2C9CYP2C19CYP3A4
SCHEMBL23841252 0.92 MAPK1 (0.39) ALDH1A1SMN1; SMN2CYP2C9CYP2C19CYP3A4
SCHEMBL23900255 0.92 OPRM1 (0.49) ALDH1A1SMN1; SMN2CYP2C9CYP2C19CYP3A4
SCHEMBL15290736 0.90 OPRM1 (0.46) ALDH1A1SMN1; SMN2CYP2C9CYP2C19CYP3A4
SCHEMBL23841259 0.85 ALDH1A1 (0.40) ALDH1A1SMN1; SMN2CYP2C9CYP2C19CYP3A4
SCHEMBL12988080 0.84 OPRM1 (0.42) ALDH1A1SMN1; SMN2CYP2C9CYP2C19CYP3A4
SCHEMBL20858665 0.81 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2CYP2C9CYP2C19CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112939765-B Method for co-producing adipic acid and cyclohexanone oxime from cyclohexane 湘潭大学 2022-08-09 CN claimed
CN-112939808-A Preparation method of cyclohexanone oxime 湘潭大学 2021-06-11 CN claimed
CN-112939765-A Method for co-producing adipic acid and cyclohexanone oxime from cyclohexane 湘潭大学 2021-06-11 CN claimed
CN-111153831-A Preparation method of cyclohexanone oxime 湘潭大学 2020-05-15 CN claimed
CN-107118125-B A kind of preparation method of cyclohexanone oxime 湘潭大学 2019-05-14 CN claimed
CN-107118125-A A kind of preparation method of cyclohexanone oxime 湘潭大学 2017-09-01 CN claimed
JP-7165816-A None JP disclosed
EP-4524194-A1 RESIN COMPOSITION AND MOLDED OBJECT Kuraray Co., Ltd. (JP) 2025-03-19 EP disclosed
CN-119343403-A Resin composition and molded article 株式会社可乐丽 2025-01-21 CN disclosed
WO-2023219103-A1 RESIN COMPOSITION AND MOLDED OBJECT 株式会社クラレ 2023-11-16 WO disclosed
CN-111153831-B Preparation method of cyclohexanone oxime 湘潭大学 2022-11-01 CN disclosed
CN-112939765-B Method for co-producing adipic acid and cyclohexanone oxime from cyclohexane 湘潭大学 2022-08-09 CN disclosed
CN-112939765-A Method for co-producing adipic acid and cyclohexanone oxime from cyclohexane 湘潭大学 2021-06-11 CN disclosed
US-9150414-B2 Nanocomposite and dispersion comprising the same KABUSHIKI KAISHA TOYOTA CHUO KENKYUSHO (JP) 2015-10-06 US disclosed
EP-2672561-A1 NON-AQUEOUS ELECTROLYTIC SOLUTION, AND NON-AQUEOUS ELECTROLYTE SECONDARY BATTERY USING SAME Mitsubishi Chemical Corporation (JP) 2013-12-11 EP disclosed
US-20130316229-A1 NON-AQUEOUS ELECTROLYTE SOLUTION AND NON-AQUEOUS ELECTROLYTE SECONDARY BATTERY EMPLOYING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2013-11-28 US disclosed
CN-103339784-A Nonaqueous electrolyte solution and nonaqueous electrolyte secondary battery using same MITSUBISHI CHEM CORP 2013-10-02 CN disclosed
US-20120053288-A1 NANOCOMPOSITE AND DISPERSION COMPRISING THE SAME KABUSHIKI KAISHA TOYOTA CHUO KENKYUSHO (JP) 2012-03-01 US disclosed
JP-H07165816-A HEAT-RESISTANT RESIN UBE IND LTD 1995-06-27 JP disclosed
EP-0484722-A1 Moulding composition BASF Aktiengesellschaft (DE) 1992-05-13 EP disclosed