SCHEMBL93283

SCHEMBL93283

Cc1cc(C)cc(NC(=O)O)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.55
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
HTT P42858 1/20 0.55
THRB P10828 1/20 0.55
LMNA P02545 1/20 0.53
MAPT P10636 3/20 0.53
KDM4E B2RXH2 2/20 0.53
ALDH1A1 P00352 1/20 0.53
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
HDAC3 O15379 1/20 0.52
HDAC4 P56524 1/20 0.52
HDAC1 Q13547 1/20 0.52
HDAC7 Q8WUI4 1/20 0.52
HDAC2 Q92769 1/20 0.52
HDAC10 Q969S8 1/20 0.52
HDAC11 Q96DB2 1/20 0.52
HDAC8 Q9BY41 1/20 0.52
HDAC6 Q9UBN7 1/20 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
SCHEMBL28002199 0.85 NPSR1 (0.56) NPSR1MEN1KMT2AHTTTHRB
SCHEMBL28069063 0.85 CYP1A2 (0.50) NPSR1MEN1KMT2AHTTTHRB
SCHEMBL19989306 0.84 MAPT (0.48) NPSR1MEN1KMT2AHTTTHRB
SCHEMBL29177326 0.84 HDAC3 (0.46) NPSR1MEN1KMT2AHTTTHRB
SCHEMBL30801100 0.84 MAPT (0.48) NPSR1MEN1KMT2AHTTTHRB
SCHEMBL13735692 0.84 HDAC3 (0.44) NPSR1MEN1KMT2AHTTTHRB
SCHEMBL27923493 0.84 MEN1 (0.73) NPSR1MEN1KMT2AHTTTHRB
SCHEMBL28041785 0.83 GPR35 (0.57) NPSR1MEN1KMT2AHTTTHRB
SCHEMBL849875 0.82 MEN1 (0.77) NPSR1MEN1KMT2AHTTTHRB
Benzamide SCHEMBL28002190 0.81 THRB (0.57) MEN1KMT2ATHRBMAPTCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118348148-A High performance liquid chromatography detection method for cinacalcet hydrochloride enantiomer 山东威高药业股份有限公司 2024-07-16 CN claimed
CN-116196909-B Silica gel @ polyaniline @ polysaccharide derivative core-shell CSP filler and preparation method and application thereof 昆明医科大学 2024-07-16 CN claimed
CN-118294554-A Detection method of pitavastatin calcium impurity 乳源东阳光药业有限公司 2024-07-05 CN claimed
CN-118191138-A Chiral chromatographic detection method and application of metalaxyl enantiomer 广西中烟工业有限责任公司 2024-06-14 CN claimed
CN-118201940-A AKR1C3 activated DNA alkylating agent and medical application thereof 深圳艾欣达伟医药科技有限公司 2024-06-14 CN claimed
CN-115792026-B Method for detecting enantiomer and diastereomer of larrotib 安徽联创生物医药股份有限公司 2024-06-04 CN claimed
CN-118112140-A Method for detecting enantiomer of (1R, 5S) -3-ethyl-bicyclo [3.2.0] heptane-3-alkene-6-ketone 重庆华森制药股份有限公司 2024-05-31 CN claimed
CN-117969685-A Liquid chromatographic separation detection method for nicotine and enantiomer thereof 苏州博研医药科技有限公司 2024-05-03 CN claimed
CN-117890507-A Liquid chromatography detection method for protecting amino acid impurities 江苏诺泰澳赛诺生物制药股份有限公司 2024-04-16 CN claimed
CN-117761200-A Detection method for simultaneously detecting flurbiprofen axetil isomer and flurbiprofen isomer 南京一诺医药科技有限公司 2024-03-26 CN claimed
US-5639824-A WITH CYCLODEXTRIN SUBSTITUTED WITH 3,5-DIMETHYLPHENYL CARBAMATE AT EITHER THE 2-, 3- OR 6-POSITION AND BONDED TO SUPPORT THROUGH SPACER CONTAINING EITHER CARBAMATE OR ESTER(BUT NOT ETHER) GROUPS, FOR OPTICAL RESOLUTION DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1997-06-17 US claimed
JP-2598819-B2 1997-04-09 JP claimed
US-5571929-A Resolution and reduction of physostigmine intermediates and derivatives THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1996-11-05 US claimed
US-5543506-A USING POLYSACCHARIDES HAVING SUBSTITUTED HYDROXYL AND/OR AMINE GROUPS FOR PACKING CHROMATOGRAPHY COLUMNS IN RESOLUTION OF RACEMIC MIXTURES DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1996-08-06 US claimed
WO-1996017828-A1 RESOLUTION AND REDUCTION OF PHYSOSTIGMINE INTERMEDIATES AND DERIVATIVES THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1996-06-13 WO claimed
US-5491223-A OPTICAL RESOLUTION DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1996-02-13 US claimed
EP-0340243-B1 CC-1065 ANALOGS UPJOHN CO (US) 1994-09-28 EP claimed
EP-0527235-A1 NOVEL POLYSACCHARIDE DRIVATIVE AND SEPARATING AGENT DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1993-02-17 EP claimed
EP-0340243-A1 CC-1065 ANALOGS. UPJOHN CO (US) 1989-11-08 EP claimed
WO-1988004659-A2 NOVEL CC-1065 ANALOGS THE UPJOHN COMPANY (US) 1988-06-30 WO claimed