SCHEMBL8074840

SCHEMBL8074840

C=CCOc1ccc(Cl)c2c1[S+]([O-])c1ccccc1C2

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 3/20 0.45
ADRA2B P18089 3/20 0.45
ADRA2C P18825 3/20 0.45
HTR2C P28335 6/20 0.37
HTR2A P28223 5/20 0.37
HPGD P15428 2/20 0.34
TSHR P16473 2/20 0.34
MAPK1 P28482 1/20 0.34
HSD17B10 Q99714 1/20 0.34
ADRA1D P25100 1/20 0.34
ADRA1A P35348 1/20 0.34
ADRA1B P35368 1/20 0.34
GAA P10253 1/20 0.32
CXCR5 P32302 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LIG1 P18858 1/20 0.30
HTR2B P41595 2/20 0.30

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
SCHEMBL133173 0.82 CSNK2A1 (0.35) ADRA2AADRA2BADRA2CHTR2CHTR2A
SCHEMBL6493951 0.80 TDP1 (0.40) TSHR
SCHEMBL14721610 0.79 THRA (0.32) MAPK1
SCHEMBL8065205 0.79 HTT (0.34)
SCHEMBL1615176 0.79 S1PR5 (0.36) ADRA2AHPGDTSHRHTR2B
SCHEMBL3159501 0.79 S1PR5 (0.36) ADRA2AHPGDTSHRHTR2B
SCHEMBL8065187 0.77 MEN1 (0.39) HPGDMAPK1ALDH1A1
SCHEMBL1614837 0.77 S1PR1 (0.32)
SCHEMBL8080081 0.75 KDM4E (0.37) ADRA2AADRA2BADRA2CHPGDTSHR
SCHEMBL84111 0.73 MEN1 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0520574-B1 Thioxanthone derivatives LAMBSON FINE CHEMICALS LIMITED (GB) 2000-08-16 EP disclosed
US-5414092-A Photoinitiators INTERNATIONAL BIO-SYNTHETICS LIMITED (GB) 1995-05-09 US disclosed
EP-0520574-A1 Thioxanthone derivatives GREAT LAKES FINE CHEMICALS LIMITED (GB) 1992-12-30 EP disclosed