SCHEMBL252240

SCHEMBL252240

C=CCNCCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 3/20 0.56
SIGMAR1 Q99720 7/20 0.55
GAA P10253 2/20 0.55
MAPT P10636 1/20 0.55
NPC1 O15118 2/20 0.48
ALDH1A1 P00352 2/20 0.48
RAB9A P51151 2/20 0.48
ATM Q13315 1/20 0.48
TAAR1 Q96RJ0 1/20 0.48
KDM1A O60341 1/20 0.48
LMNA P02545 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
HTR1A P08908 1/20 0.48
ADRA2A P08913 1/20 0.48
CYP2C8 P10632 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
IDO1 P14902 1/20 0.48
TSHR P16473 1/20 0.48

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
Hydrochloric Acid SCHEMBL2236705 0.98 GAA (0.59) KCNH2SIGMAR1GAAMAPTNPC1
SCHEMBL8655738 0.98 KCNH2 (0.55) KCNH2SIGMAR1GAAMAPTNPC1
SCHEMBL3234147 0.88 SIGMAR1 (0.67) KCNH2SIGMAR1
SCHEMBL6381502 0.84 KCNH2 (0.42) KCNH2SIGMAR1GAAMAPTNPC1
SCHEMBL1358088 0.82 SIGMAR1 (0.59) KCNH2SIGMAR1GAAMAPT
SCHEMBL11773805 0.82 NPC1 (0.47) KCNH2SIGMAR1GAAMAPTNPC1
SCHEMBL7103008 0.81 SIGMAR1 (0.57) KCNH2SIGMAR1GAAMAPTNPC1
SCHEMBL17626920 0.80 TAAR1 (0.52) TAAR1LMNACYP1A2CYP2D6IDO1
SCHEMBL10839600 0.80 SMN1; SMN2 (0.43) NPC1ALDH1A1RAB9ASMN1; SMN2KDM4E
SCHEMBL10450208 0.80 MAPT (0.43) KCNH2SIGMAR1GAAMAPTNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116283672-B Synthesis method and application of beta-allyl phenethylamine derivative 四川师范大学 2024-09-17 CN claimed
CN-116283672-A Synthesis method and application of beta-allyl phenethylamine derivative 四川师范大学 2023-06-23 CN claimed
WO-2020162723-A1 POROUS LIQUID COMPOSITION COMPRISING METAL-ORGANIC UNIT, POROUS POLYMER COMPOSITION, AND PREPARATION METHOD THEREFOR 숙명여자대학교산학협력단 2020-08-13 WO claimed
US-7803146-B2 Sweat-absorbent sheet and process for making the same UNI-CHARM CORPORATION (JP) 2010-09-28 US claimed
EP-1967626-A1 SWEAT-ABSORBENT SHEET AND METHOD FOR PRODUCTION THEREOF UNICHARM CORPORATION (JP) 2008-09-10 EP claimed
EP-1960379-A1 N-(1-ALKYL-2-PHENYLETHYL)-CARBOXAMIDE DERIVATIVES AND USE THEREOF AS FUNGICIDES Bayer CropScience S.A. (FR) 2008-08-27 EP claimed
EP-1960350-A1 NEW N-(1-METHYL-2PHENYLETHYL)BENZAMIDE DERIVATIVES BAYER CROPSCIENCE SA (FR) 2008-08-27 EP claimed
US-20070149933-A1 Sweat-Absorbent Sheet and Process for Making the Same UNI-CHARM CORPORATION (JP) 2007-06-28 US claimed
WO-2007060164-A1 N-(1-ALKYL-2-PHENYLETHYL)-CARBOXAMIDE DERIVATIVES AND USE THEREOF AS FUNGICIDES BAYER CROPSCIENCE SA (FR) 2007-05-31 WO claimed
WO-2007060162-A1 NEW N-(1-METHYL-2PHENYLETHYL)BENZAMIDE DERIVATIVES BAYER CROPSCIENCE SA (FR) 2007-05-31 WO claimed
CN-1678620-A Macrolide compounds with anti-inflammatory activity ZAMBON SPA (IT) 2005-10-05 CN claimed
EP-0843682-A1 HIGH PURITY FORMULATIONS OF HIGHLY SUBSTITUTED LITHIUM AMIDE BASES FMC CORPORATION (US) 1998-05-27 EP claimed
WO-1997006173-A1 HIGH PURITY FORMULATIONS OF HIGHLY SUBSTITUTED LITHIUM AMIDE BASES FMC CORPORATION (US) 1997-02-20 WO claimed
WO-1997002210-A2 CONTAMINANT FREE ORGANOMETALLIC AMIDE COMPOSITIONS AND PROCESSES FOR MAKING SAME FMC CORPORATION (US) 1997-01-23 WO claimed
EP-0274259-A2 New renin-inhibitory oligopeptides, their preparaton and their use Sankyo Company Limited (JP) 1988-07-13 EP claimed
EP-4104902-B1 COMPOUNDS AND MEDICAMENTS USING SAME IRIMAJIRI THERAPEUTICS INC (JP) 2026-05-27 EP disclosed
US-20240238759-A1 Preparation Method for Super Absorbent Polymer LG CHEM, LTD. (KR) 2024-07-18 US disclosed
EP-0064158-A1 Omega-cyano-1, omega-diphenyl azalcane derivatives, their preparation and pharmaceutical preparations containing them BASF Aktiengesellschaft (DE) 1982-11-10 EP disclosed
US-4336400-A BRONCHODILATOR AGENTS, CARDIOVASCULAR STIMULANTS STERLING DRUG INC. (US) 1982-06-22 US disclosed
US-4138581-A BRONCHODILATOR AGENTS, ADRENERGIC STIMULANTS STERLING DRUGS INC. (US) 1979-02-06 US disclosed