SCHEMBL508935

SCHEMBL508935

CCCCc1ccc(/N=N/c2ccc(O)cc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.66
CYP3A4 P08684 3/20 0.66
ADRA2A P08913 2/20 0.66
ADORA3 P0DMS8 2/20 0.66
TACR2 P21452 2/20 0.66
SLC6A2 P23975 2/20 0.66
SLC6A4 P31645 2/20 0.66
SLC6A3 Q01959 2/20 0.66
ALDH1A1 P00352 2/20 0.66
HSD17B10 Q99714 2/20 0.66
KDM4E B2RXH2 1/20 0.66
LMNA P02545 1/20 0.66
SHBG P04278 1/20 0.66
TP53 P04637 1/20 0.66
HSPD1 P10809 1/20 0.66
ADRB3 P13945 1/20 0.66
HTR2C P28335 1/20 0.66
HSPE1 P61604 1/20 0.66
HIF1A Q16665 1/20 0.66
TST Q16762 1/20 0.66

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
SCHEMBL508936 1.00 ESR1 (0.66) ESR1CYP3A4ADRA2AADORA3TACR2
SCHEMBL20579978 1.00 ESR1 (0.66) ESR1CYP3A4ADRA2AADORA3TACR2
SCHEMBL20579977 1.00 ESR1 (0.66) ESR1CYP3A4ADRA2AADORA3TACR2
SCHEMBL6679677 0.94 CYP3A4 (0.75) ESR1CYP3A4ADRA2AADORA3TACR2
SCHEMBL6679674 0.94 CYP3A4 (0.75) ESR1CYP3A4ADRA2AADORA3TACR2
SCHEMBL13417483 0.93 PTGS2 (0.79) ESR1CYP3A4ADRA2AADORA3TACR2
SCHEMBL9473502 0.93 PTGS2 (0.79) ESR1CYP3A4ADRA2AADORA3TACR2
SCHEMBL1584415 0.93 PTGS2 (0.79) ESR1CYP3A4ADRA2AADORA3TACR2
SCHEMBL9689370 0.93 PTGS2 (0.79) ESR1CYP3A4ADRA2AADORA3TACR2
SCHEMBL9689372 0.93 PTGS2 (0.79) ESR1CYP3A4ADRA2AADORA3TACR2

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-9279054-A None JP disclosed
WO-2024100181-A1 DSA OF LIQUID CRYSTAL BLOCK COPOLYMERS FOR INTEGRATED CIRCUIT PATTERNING MERCK PATENT GMBH (DE) 2024-05-16 WO disclosed
WO-2020213641-A1 PHOTORESPONSIVE POLY(VINYL ETHER) COMPOUND AND OPTICALLY REVERSIBLE ADHESIVE 国立研究開発法人産業技術総合研究所 2020-10-22 WO disclosed
CN-107075263-B Light-sensitive composite material, method for producing same, and method for using light-sensitive composite material film 国立研究开发法人产业技术综合研究所 2020-06-30 CN disclosed
US-8435333-B2 Photo-switchable membrane and method UNIVERSITY OF ROCHESTER (US) 2013-05-07 US disclosed
WO-2012110745-A1 PHOTOSTIMULABLE SURFACTANT CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2012-08-23 WO disclosed
US-20120025136-A1 PHOTO-SWITCHABLE MEMBRANE AND METHOD UNIVERSITY OF ROCHESTER (US) 2012-02-02 US disclosed
JP-H09279054-A AZO COMPOUND DOUJIN KAGAKU KENKYUSHO:KK 1997-10-28 JP disclosed