SCHEMBL979655

SCHEMBL979655

O=C1CCCCC1=Cc1ccccc1

nearest known ligand 0.92

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.92
HTT P42858 1/20 0.92
CYP1A2 P05177 2/20 0.68
F3 P13726 1/20 0.68
AKR1C3 P42330 1/20 0.61
AKR1C1 Q04828 1/20 0.61
MAPT P10636 5/20 0.61
HPGD P15428 4/20 0.61
NPC1 O15118 1/20 0.61
RAB9A P51151 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
MGAM O43451 3/20 0.56
GAA P10253 3/20 0.56
SI P14410 3/20 0.56
MGAM2 Q2M2H8 3/20 0.56
LMNA P02545 2/20 0.55
MIF P14174 2/20 0.54
KMT2A Q03164 2/20 0.51
EGFR P00533 2/20 0.51
MEN1 O00255 1/20 0.51

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
SCHEMBL979654 1.00 ALDH1A1 (0.92) ALDH1A1HTTCYP1A2F3AKR1C3
SCHEMBL10734311 1.00 ALDH1A1 (0.92) ALDH1A1HTTCYP1A2F3AKR1C3
SCHEMBL9047295 0.98 ALDH1A1 (0.89) ALDH1A1HTTCYP1A2F3AKR1C3
SCHEMBL11807335 0.98 ALDH1A1 (0.89) ALDH1A1HTTCYP1A2F3AKR1C3
SCHEMBL9047298 0.98 ALDH1A1 (0.89) ALDH1A1HTTCYP1A2F3AKR1C3
SCHEMBL11807333 0.98 ALDH1A1 (0.89) ALDH1A1HTTCYP1A2F3AKR1C3
SCHEMBL10959168 0.98 ALDH1A1 (0.89) ALDH1A1HTTCYP1A2F3AKR1C3
SCHEMBL812295 0.96 ALDH1A1 (1.00) ALDH1A1HTTCYP1A2F3AKR1C3
SCHEMBL1524525 0.96 ALDH1A1 (1.00) ALDH1A1HTTCYP1A2F3AKR1C3
SCHEMBL809531 0.96 ALDH1A1 (1.00) ALDH1A1HTTCYP1A2F3AKR1C3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119306662-A Method for constructing molten pyridine compound by copper-catalyzed [2+1+3] cyclization reaction of cyclic ketone with alpha, beta-unsaturated aldehyde/ketone and ammonium iodide 湖南大学 2025-01-14 CN claimed
CN-118675633-A Explosion limit control method for preparing epsilon-caprolactone intrinsically safe by cyclohexanone 广东工业大学 2024-09-20 CN claimed
CN-118225950-A In-situ analysis method for product of epsilon-caprolactone prepared by continuous flow air oxidation of cyclohexanone 滕州市腾龙食品科技发展有限公司 2024-06-21 CN claimed
CN-113845407-B Method for preparing ortho-cyclohexanedione 八叶草健康产业研究院(厦门)有限公司 2024-04-05 CN claimed
CN-116043244-A Method for preparing alpha, beta-unsaturated ketone by electrocatalytic oxidation of alcohol 北京化工大学 2023-05-02 CN claimed
CN-111217769-B Method for synthesizing epoxy compound by catalyzing olefin epoxy by using nano alumina 华南理工大学 2023-04-21 CN claimed
CN-113845407-A Method for preparing ortho-cyclohexanedione 八叶草健康产业研究院(厦门)有限公司 2021-12-28 CN claimed
CN-111217769-A Method for synthesizing epoxy compound by catalyzing olefin epoxidation through nano aluminum oxide 华南理工大学 2020-06-02 CN claimed
CN-105067740-B A kind of bionic catalysis cyclohexanone gas-liquid phase oxidation prepares the product analysis method of ε caprolactones 中山大学惠州研究院 2017-03-15 CN claimed
CN-105067740-A Method for analyzing products generated during process of biomimetic catalytic cyclohexanone gas-liquid phase oxidation for producing epsilon-caprolactone HUIZHOU RES INST OF SUN YAT SEN UNIVERSITY 2015-11-18 CN claimed
WO-2004022016-A1 AGENTS USED FOR DYEING KERATINOUS FIBERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2004-03-18 WO claimed
WO-2003030845-A1 AGENT FOR THE COLORATION OF KERATIN-CONTAINING FIBERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2003-04-17 WO claimed
EP-0873743-A2 Use of benzylidene-ketones for dyeing keratinous fibers Henkel Kommanditgesellschaft auf Aktien (DE) 1998-10-28 EP claimed
EP-0378953-B1 Benzylidene azolyl methyl cycloalkane and its use as a fungicide RHONE POULENC AGROCHIMIE (FR) 1996-06-05 EP claimed
US-5489623-A APPLYING POLYMER TO SURFACE, EXPOSING TO INCIDENT PHOTONICRADIATION TO RENDER PORTIONS LESS SOLUBLE OR DISPERSIBLE THE DOW CHEMICAL COMPANY (US) 1996-02-06 US claimed
EP-0676062-A1 PHOTODEFINABLE POLYMERS CONTAINING PERFLUOROCYCLOBUTANE GROUPS THE DOW CHEMICAL COMPANY (US) 1995-10-11 EP claimed
US-5426164-A Solvent and chemical resistant coatings and photoresists; photocuring of perfluorovinyl polymers containing photo active sites; cyclization THE DOW CHEMICAL COMPANY (US) 1995-06-20 US claimed
WO-1994015258-A1 PHOTODEFINABLE POLYMERS CONTAINING PERFLUOROCYCLOBUTANE GROUPS THE DOW CHEMICAL COMPANY (US) 1994-07-07 WO claimed
EP-0223373-A1 Water-soluble photoinitiators AUTOTYPE INTERNATIONAL LIMITED (GB) 1987-05-27 EP claimed
EP-0164598-A2 Photosensitive resin composition and process for forming photo-resist pattern using the same NIPPON TELEGRAPH AND TELEPHONE CORPORATION (JP) 1985-12-18 EP claimed