SCHEMBL3471747

SCHEMBL3471747

COc1cc(C=NO)cc(OC)c1OC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
ALDH1A1 P00352 6/20 0.58
HTT P42858 4/20 0.58
KMT2A Q03164 4/20 0.58
MEN1 O00255 3/20 0.58
HSD17B10 Q99714 3/20 0.57
CYP1A2 P05177 3/20 0.57
CYP3A4 P08684 3/20 0.57
CYP2C19 P33261 2/20 0.57
PKM P14618 1/20 0.57
MAPK1 P28482 1/20 0.57
AMY1A P0DUB6 1/20 0.54
MAPT P10636 5/20 0.52
GAA P10253 3/20 0.52
LMNA P02545 3/20 0.50
KDM4E B2RXH2 1/20 0.50
HTR1A P08908 1/20 0.50
HTR2C P28335 1/20 0.50
CYP1A1 P04798 1/20 0.50

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
SCHEMBL3471744 1.00 HPGD (0.59) HPGDSMN1; SMN2ALDH1A1HTTKMT2A
SCHEMBL15463039 1.00 HPGD (0.59) HPGDSMN1; SMN2ALDH1A1HTTKMT2A
SCHEMBL22824610 0.90 ALDH1A1 (0.54) HPGDSMN1; SMN2ALDH1A1HTTKMT2A
SCHEMBL30393930 0.89 ALDH1A1 (0.52) HPGDSMN1; SMN2ALDH1A1HTTKMT2A
SCHEMBL10050296 0.89 ALDH1A1 (0.52) HPGDSMN1; SMN2ALDH1A1HTTKMT2A
SCHEMBL7120261 0.87 ALDH1A1 (0.51) HPGDSMN1; SMN2ALDH1A1HTTKMT2A
SCHEMBL7120256 0.87 ALDH1A1 (0.51) HPGDSMN1; SMN2ALDH1A1HTTKMT2A
SCHEMBL2446290 0.87 ALDH1A1 (0.75) HPGDSMN1; SMN2ALDH1A1HTTKMT2A
SCHEMBL12120526 0.87 HSD17B10 (0.75) HPGDSMN1; SMN2ALDH1A1HTTKMT2A
SCHEMBL2446293 0.87 ALDH1A1 (0.75) HPGDSMN1; SMN2ALDH1A1HTTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118146135-A Substituted pyrrole compound and preparation method and application thereof 沈阳药科大学 2024-06-07 CN claimed
CN-106279027-A (1 aryl 1H pyrazoles 4 base) (3,4,5 trimethoxyphenyl) ketone, ketoxime compounds and application thereof 沈阳药科大学 2017-01-04 CN claimed
CN-118146135-A Substituted pyrrole compound and preparation method and application thereof 沈阳药科大学 2024-06-07 CN disclosed
CN-118056820-A 2, 4-Disubstituted thiophene compound and preparation method and application thereof 沈阳药科大学 2024-05-21 CN disclosed
CN-114957123-B 3- (difluoromethyl) -pyrazole-4-carboxylic ester derivative and preparation method and application thereof 浙江工业大学 2023-11-28 CN disclosed
CN-114957124-B 3- (trifluoromethyl) -pyrazole-4-carboxylic ester derivative and preparation method and application thereof 浙江工业大学 2023-11-07 CN disclosed
CN-114957124-A 3- (trifluoromethyl) -pyrazole-4-carboxylic ester derivative and preparation method and application thereof 浙江工业大学 2022-08-30 CN disclosed
CN-114957123-A 3- (difluoromethyl) -pyrazole-4-carboxylic ester derivative and preparation method and application thereof 浙江工业大学 2022-08-30 CN disclosed
CN-108794419-B Naphtho [2,3-b ] isoxazole-4, 9-diketone derivative and preparation method and application thereof 中南大学 2022-07-05 CN disclosed
CN-106279056-B (5-aryl-1, 2, 4-oxadiazole-3-yl) (3,4, 5-trimethoxyphenyl) -methanol, -ketone oxime compound and application thereof 沈阳药科大学 2019-12-10 CN disclosed
CN-104382924-B N6 substituted adenosines derivative and N6 substituted adenines derivatives and application thereof 中国医学科学院药物研究所 2017-12-22 CN disclosed
CN-104744297-A Anti-hepatitis B virus (HBV) activity phenylpropanoid benzaldehyde oxime ester type compounds UNIV GUANGXI 2015-07-01 CN disclosed
CN-104610230-A Compounds for the treatment of cancer UNIV TENNESSEE RES FOUNDATION 2015-05-13 CN disclosed
CN-104592205-A COMPOUNDS FOR TREATMENT OF CANCER GTX INC 2015-05-06 CN disclosed
CN-104382924-A N6-substituted adenosine derivative and N6-substituted adenine derivative and application thereof INST MATERIA MEDICA CAMS 2015-03-04 CN disclosed
CN-102137592-B Compounds for the treatment of cancer UNIV TENNESSEE RES FOUNDATION (US) 2015-01-28 CN disclosed
CN-103755664-A 4-arylthia(selena)zole compounds and application thereof UNIV SHENYANG PHARMACEUTICAL 2014-04-30 CN disclosed
CN-102030680-B Novel oxime ether or ester derivatives with insecticidal activity HUBEI ENGINEERING RES CT OF BIO PESTICIDE 2014-03-26 CN disclosed
CN-102883607-A Compounds for the treatment of cancer GTX INC (US) 2013-01-16 CN disclosed
WO-2010074776-A2 COMPOUNDS FOR THE TREATMENT OF CANCER THE UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2010-07-01 WO disclosed