SCHEMBL1107500

SCHEMBL1107500

Cc1ccc(C(=O)C=O)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.70
HTT P42858 3/20 0.70
NPSR1 Q6W5P4 3/20 0.70
LMNA P02545 3/20 0.70
TDP1 Q9NUW8 3/20 0.70
HPGD P15428 3/20 0.70
PKM P14618 2/20 0.70
ATM Q13315 2/20 0.70
SMN1; SMN2 Q16637 2/20 0.70
NLRP1 Q9C000 1/20 0.70
MEN1 O00255 1/20 0.70
NTSR1 P30989 1/20 0.70
KMT2A Q03164 1/20 0.70
MAPT P10636 6/20 0.59
THRB P10828 1/20 0.59
MAPK1 P28482 1/20 0.58
CES2 O00748 2/20 0.56
CES1 P23141 2/20 0.56
RAB9A P51151 3/20 0.52
NPC1 O15118 2/20 0.52

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
Water SCHEMBL10349979 0.98 ALDH1A1 (0.67) ALDH1A1HTTNPSR1LMNATDP1
Sulfurous Acid SCHEMBL11517587 0.91 ALDH1A1 (0.59) ALDH1A1HTTNPSR1LMNATDP1
SCHEMBL222221 0.87 ALDH1A1 (0.74) ALDH1A1HTTNPSR1LMNATDP1
SCHEMBL8922721 0.84 ALDH1A1 (0.52) ALDH1A1HTTNPSR1LMNATDP1
Water SCHEMBL11592745 0.84 ALDH1A1 (0.70) ALDH1A1HTTNPSR1LMNATDP1
Water SCHEMBL11592742 0.84 ALDH1A1 (0.70) ALDH1A1HTTNPSR1LMNATDP1
SCHEMBL28984937 0.82 ALDH1A1 (1.00) ALDH1A1HTTNPSR1LMNATDP1
SCHEMBL25031353 0.81 ALDH1A1 (0.54) ALDH1A1HTTNPSR1LMNATDP1
SCHEMBL7701991 0.80 ALDH1A1 (0.70) ALDH1A1HTTNPSR1LMNATDP1
Xenygloxal SCHEMBL2110325 0.79 ALDH1A1 (0.64) ALDH1A1HTTNPSR1LMNATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116425681-A Green synthesis method of cyazofamid 青岛农业大学 2023-07-14 CN claimed
US-5610016-A REACTING A GLYOXAL DERIVATIVE, CHEMILUMINESCENCE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1997-03-11 US claimed
EP-0675360-A2 Method for measuring adenyl group containing substances using heteropoly acid MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1995-10-04 EP claimed
US-4337346-A CONDENSATION OF A GLYOXAL WITH AN N-SUBSTITUTED AMINOMETHYLPYRROLIDINE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1982-06-29 US claimed
CN-122059895-A Preparation method of 1,2, 4-triazine derivative 江西同和药业股份有限公司 2026-05-19 CN disclosed
CN-119504474-A Preparation method of phenyl ketone amide compound 淮北师范大学 2025-02-25 CN disclosed
CN-117758282-B Electrocatalytic preparation method of (indolizine-3-yl) -ethanedione derivative 上海陶术生物科技有限公司 2025-01-14 CN disclosed
CN-118994018-A Synthesis method of 1,3, 4-triarylimidazole thioketone derivative 江苏建筑职业技术学院 2024-11-22 CN disclosed
WO-2024146902-A1 METHODS OF PRODUCING HYDROGEL MICROSPHERES ASCENDIS PHARMA A/S (DK) 2024-07-11 WO disclosed
CN-117758282-A Electrocatalytic preparation method of (indolizine-3-yl) -ethanedione derivative 上海陶术生物科技有限公司 2024-03-26 CN disclosed
CN-116425681-A Green synthesis method of cyazofamid 青岛农业大学 2023-07-14 CN disclosed
CN-116425681-A Green synthesis method of cyazofamid 青岛农业大学 2023-07-14 CN disclosed
EP-0201221-A1 6-(1-acyl-1-hydroxy methyl) penicillanic acid derivatives PFIZER INC. (US) 1986-11-12 EP disclosed
US-4584387-A INTERMEDIATES FOR ALPHA-HYDROXY ALDEHYDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-04-22 US disclosed
EP-0050351-B1 OPTICALLY ACTIVE OR RACEMIC ALPHA-HYDROXYALDEHYDES AND BENZYL DERIVATIVES THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1985-03-27 EP disclosed
US-4383122-A HYDROCARBOYL-1,3-DIAZABICYCLO(3.3.0)OCTANE, GRIGNARD REAGENT SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1983-05-10 US disclosed
EP-0011417-B1 OPTICALLY ACTIVE OR RACEMIC AMINAL DERIVATIVES, PROCESS FOR PREPARING SAME AND FOR CONVERTING SAME TO ALPHA-HYDROXYALDEHYDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1983-05-04 EP disclosed
US-4337346-A CONDENSATION OF A GLYOXAL WITH AN N-SUBSTITUTED AMINOMETHYLPYRROLIDINE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1982-06-29 US disclosed
EP-0050351-A1 Optically active or racemic alpha-hydroxyaldehydes and benzyl derivatives thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1982-04-28 EP disclosed
US-4046763-A INTERMEDIATE FOR ULTRAVIOLET LIGHT ABSORBERS MCNEIL LABORATORIES, INCORPORATED (US) 1977-09-06 US disclosed