SCHEMBL501628

SCHEMBL501628

NCC(N)C=Cc1ccccc1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.46
CA2 P00918 7/20 0.44
CA12 O43570 6/20 0.44
NFKB1 P19838 2/20 0.44
CDK4 P11802 1/20 0.44
CCND1 P24385 1/20 0.44
KDM4E B2RXH2 1/20 0.44
JUN P05412 1/20 0.44
NFE2L2 Q16236 1/20 0.44
CA1 P00915 1/20 0.43
CA4 P22748 1/20 0.43
LMNA P02545 2/20 0.42
MAPT P10636 1/20 0.42
TRIM24 O15164 1/20 0.41
TRIM33 Q9UPN9 1/20 0.41
BCHE P06276 1/20 0.40
GUSB P08236 1/20 0.40
CA9 Q16790 5/20 0.38
ECE2 P0DPD6 2/20 0.37
CHRNA7 P36544 1/20 0.37

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
SCHEMBL14146002 0.72 HTR2A (0.47) MEN1KMT2A
SCHEMBL347781 0.72 TRPA1 (0.52) TRPA1CA2CA12NFKB1CDK4
SCHEMBL12425707 0.72 TRPA1 (0.52) TRPA1CA2CA12NFKB1CDK4
SCHEMBL21166609 0.72 TRPA1 (0.52) TRPA1CA2CA12NFKB1CDK4
SCHEMBL31186857 0.72 TRPA1 (0.52) TRPA1CA2CA12NFKB1CDK4
SCHEMBL717976 0.72 TRPA1 (0.76) TRPA1CA2CA12NFKB1CDK4
SCHEMBL108389 0.72 TRPA1 (0.76) TRPA1CA2CA12NFKB1CDK4
SCHEMBL49775 0.71 TRPA1 (0.43) TRPA1CA2CA12NFKB1CDK4
SCHEMBL1697046 0.71 TRPA1 (0.43) TRPA1CA2CA12NFKB1CDK4
SCHEMBL29384449 0.71 TRPA1 (0.43) TRPA1CA2CA12NFKB1CDK4

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 1104 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117551491-A Flame-retardant hydraulic oil and preparation method and application thereof 中国石油化工股份有限公司 2024-02-13 CN claimed
CN-115820327-A Preparation method of cutting fluid for protecting and passivating cutting surface of metal plate 滁州默尔新材料科技有限公司 2023-03-21 CN claimed
CN-112004889-B Resin composition, laminate, semiconductor wafer with resin composition layer, substrate for mounting semiconductor with resin composition layer, and semiconductor device 三菱瓦斯化学株式会社 2022-12-09 CN claimed
EP-3410034-B1 REFRIGERATION DEVICE DAIKIN IND LTD (JP) 2022-11-23 EP claimed
EP-3410040-B1 REFRIGERANT RECOVERY DEVICE AND REFRIGERANT RECOVERY METHOD DAIKIN IND LTD (JP) 2022-11-16 EP claimed
CN-115247086-A Complexing agent for methanol gasoline, preparation method and application thereof 中国石油天然气股份有限公司 2022-10-28 CN claimed
CN-113416169-B Process for producing cyanuric chloride 营创三征(营口)精细化工有限公司 2022-07-26 CN claimed
CN-114541034-A Flame-retardant fabric and preparation method thereof 于雷 2022-05-27 CN claimed
CN-114105812-A Method for synthesizing N, N' -bis (salicylidene) -1, 2-propane diamine by using chloropropene byproduct 1, 2-dichloropropane 中国石油化工股份有限公司 2022-03-01 CN claimed
CN-111793342-B Polycarbonate composition and preparation method thereof 金发科技股份有限公司 2021-11-12 CN claimed
WO-2007042887-A1 COMPOSITION AND METHOD FOR ENHANCING THE STABILITY OF JET FUELS NALCO COMPANY (US) 2007-04-19 WO claimed
CN-1546597-A Synthetic heat conductive oil for industrial use and preparation method 山东恒利石油化工有限公司 2004-11-17 CN claimed
CN-1462794-A Gasoline antiknock FENG GUOQIANG (CN) 2003-12-24 CN claimed
CN-1081224-C Multi-effect composite additive for gasoline/diesel oil and its preparation method BEIJING AIMU SCIENCE & TECHNOL (CN) 2002-03-20 CN claimed
CN-1303489-A Dispersion aids for optical brighteners in polyolefins EASTMAN CHEM CO (US) 2001-07-11 CN claimed
CN-1263144-A Multi-effect composite additive for gasoline/diesel oil and its preparation method BEIJING AIMU SCIENCE TECHNOLOG (CN) 2000-08-16 CN claimed
CN-1039721-C Organometallic complex-antioxidant combinations, concentrates and diesel fuels containing same LUBRIZOL CORP (US) 1998-09-09 CN claimed
EP-0572866-A1 Environmentally acceptable and rapidly biodegradable functional fluid for lubrication systems of engines and other units in vehicles and machines FUCHS PETROLUB AG OEL + CHEMIE (DE) 1993-12-08 EP claimed
CN-1066675-A The low-sulfur diesel fuels that contains organometallic complex LUBRIZOL CORP (US) 1992-12-02 CN claimed
CN-1066676-A Diesel fuel containing organometallic complexes LUBRIZOL CORP (US) 1992-12-02 CN claimed