SCHEMBL531126

SCHEMBL531126

CN(C)c1ccc(/C=C/c2cc[n+](C)cc2)cc1.Cc1ccc(S(=O)(=O)[O-])cc1

nearest known ligand 0.63

Known targets — ChEMBL curated mechanism

CHRM1CHRM2CHRM3CHRM4CHRM5SLC6A2dacAdacBdacCftsImrcAmrcBmrdA

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 6/20 0.63
▸ KMT2A Q03164 6/20 0.63
▸ ALDH1A1 P00352 5/20 0.63
▸ GFER P55789 3/20 0.63
▸ MAPT P10636 3/20 0.63
▸ LMNA P02545 2/20 0.63
▸ ALPG P10696 1/20 0.63
▸ THRB P10828 1/20 0.63
▸ HTT P42858 1/20 0.63
▸ SMN1; SMN2 Q16637 1/20 0.63
▸ NPSR1 Q6W5P4 1/20 0.63
▸ RAB9A P51151 3/20 0.53
▸ GAA P10253 2/20 0.53
▸ APOBEC3A P31941 2/20 0.53
▸ APOBEC3G Q9HC16 2/20 0.53
▸ NPC1 O15118 2/20 0.53
▸ CASP1 P29466 1/20 0.51
▸ BRCA1 P38398 1/20 0.51
▸ CASP7 P55210 1/20 0.51
▸ HBB P68871 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
SCHEMBL531127 1.00 MEN1 (0.63) MEN1KMT2AALDH1A1GFERMAPT
SCHEMBL5402822 0.88 MEN1 (0.61) MEN1KMT2AALDH1A1GFERMAPT
SCHEMBL6318506 0.86 MEN1 (0.47) MEN1KMT2AALDH1A1GFERMAPT
SCHEMBL8740701 0.85 MEN1 (0.56) MEN1KMT2AALDH1A1GFERMAPT
SCHEMBL11398927 0.85 CYP2A6 (0.47) MEN1KMT2AALDH1A1GFERMAPT
SCHEMBL7044936 0.85 CYP2A6 (0.47) MEN1KMT2AALDH1A1GFERMAPT
SCHEMBL4688796 0.83 TERT (0.43) MEN1KMT2AALDH1A1GFERMAPT
SCHEMBL1402879 0.83 MEN1 (0.58) MEN1KMT2AALDH1A1GFERMAPT
SCHEMBL372527 0.83 CHAT (0.61) MEN1KMT2AALDH1A1MAPTALPG
SCHEMBL8991523 0.82 MEN1 (0.69) MEN1KMT2AALDH1A1GFERMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8861921-B2 Photovoltaic device with frequency conversion region WAKE FOREST UNIVERSITY (US) 2014-10-14 — — US claimed
US-20120134618-A1 PHOTOVOLTAIC DEVICE WITH FREQUENCY CONVERSION REGION WAKE FOREST UNIVERSITY 2012-05-31 — — US claimed
US-7854505-B2 Passive and active photonic crystal structures and devices THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2010-12-21 — — US claimed
WO-2010144438-A1 PHOTOVOLTAIC DEVICE WITH FREQUENCY CONVERSION REGION WAKE FOREST UNIVERSITY (US) 2010-12-16 — — WO claimed
US-20090323014-A1 PASSIVE AND ACTIVE PHOTONIC CRYSTAL STRUCTURES AND DEVICES THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2009-12-31 — — US claimed
US-20080128618-A1 Dendrimer Based Electro-Optic Sensor APPLIED RESEARCH AND PHOTONICS, INC. 2008-06-05 — — US claimed
US-20080099698-A1 Dendrimer Based Terahertz Generator APPLIED RESEARCH AND PHOTONICS, INC. 2008-05-01 — — US claimed
EP-1200051-B1 AGENT FOR DYING KERATIN FIBERS HENKEL KGAA (DE) 2006-02-01 — — EP claimed
US-20210098528-A1 Thermoelectric Apparatus And Applications Thereof UNIV WAKE FOREST (US) 2021-04-01 — — US disclosed
US-10868077-B2 Thermoelectric apparatus and applications thereof WAKE FOREST UNIVERSITY (US) 2020-12-15 — — US disclosed
US-10840426-B2 Thermoelectric apparatus and articles and applications thereof WAKE FOREST UNIVERSITY (US) 2020-11-17 — — US disclosed
EP-2443683-B1 WRAPPED OPTOELECTRONIC DEVICES AND METHODS FOR MAKING SAME UNIV HOUSTON (US) 2020-02-26 — — EP disclosed
EP-3226316-A1 THERMOELECTRIC APPARATUS AND ARTICLES AND APPLICATIONS THEREOF Wake Forest University (US) 2017-10-04 — — EP disclosed
US-9702870-B2 Fluorescent dyes and related methods UNIVERSITY OF WASHINGTON THROUGH ITS CENTER FOR COMMERCIALIZATION (US) 2017-07-11 — — US disclosed
US-20080002329-A1 High Dielectric, Non-Linear Capacitor POHM ARTHUR V 2008-01-03 — — US disclosed
WO-2007130025-A1 ORGANIC OPTOELECTRONIC DEVICES AND APPLICATIONS THEREOF WAKE FOREST UNIVERSITY (US) 2007-11-15 — — WO disclosed
US-20070206342-A1 High Dielectric, Non-Linear Nano-Capacitor NANO-ELECTROCHEM, INC. 2007-09-06 — — US disclosed
US-20060291278-A1 Nano-Reflectors for Thin, Flat Display Devices NANO-ELECTROCHEM, INC. (US) 2006-12-28 — — US disclosed
US-20030096502-A1 Method for levelling depressed surface of organic crystals NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE (JP) 2003-05-22 — — US disclosed
EP-1312443-A2 Method of levelling depressed surfaces of organic crystals National Institute of Advanced Industrial Science and Technology (JP) 2003-05-21 — — EP disclosed
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