SCHEMBL8089982

SCHEMBL8089982

[O-][S+](c1ccccc1)c1ccc(Sc2ccccc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.43
MAOB P27338 3/20 0.43
HPGD P15428 2/20 0.41
ALDH1A1 P00352 2/20 0.41
SLC6A4 P31645 1/20 0.37
MMP8 P22894 2/20 0.37
MMP13 P45452 2/20 0.37
MMP3 P08254 1/20 0.37
MAPT P10636 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MGLL Q99685 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CHRNA7 P36544 1/20 0.35
BCL2 P10415 1/20 0.34
MCL1 Q07820 1/20 0.34
MAPK1 P28482 2/20 0.33
NR1H2 P55055 1/20 0.33
HTR2C P28335 1/20 0.33
HTR6 P50406 1/20 0.33
CYP3A4 P08684 1/20 0.33

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
SCHEMBL9275867 0.98 MAOA (0.45) MAOAMAOBHPGDALDH1A1SLC6A4
(Phenylsulfinyl)Benzene SCHEMBL11246408 0.95 MAOA (0.41) MAOAMAOBHPGDALDH1A1SLC6A4
SCHEMBL20198244 0.94 MAOA (0.39) MAOAMAOBHPGDALDH1A1SLC6A4
SCHEMBL9624111 0.85 HTR2C (0.42) MAOAMAOBHPGDALDH1A1SLC6A4
SCHEMBL12336893 0.83 TDP1 (0.35) ALDH1A1CYP3A4TSHR
SCHEMBL92105 0.81 HPGD (0.48) MAOAMAOBHPGDALDH1A1SLC6A4
SCHEMBL31591283 0.81 HPGD (0.48) MAOAMAOBHPGDALDH1A1SLC6A4
(Phenylsulfonyl)Benzene SCHEMBL20187590 0.81 HTR6 (0.50) HPGDALDH1A1MMP8MMP13MMP3
SCHEMBL3282071 0.80 KMT2A (0.40) ALDH1A1SLC6A4MAPTSMN1; SMN2CYP3A4
SCHEMBL13369587 0.80 HPGD (0.44) MAOAMAOBHPGDALDH1A1SLC6A4

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
EP-2366752-B1 NEW MATERIALS FOR ELECTROLUMINESCENCE AND USE OF SAME MERCK PATENT GMBH (DE) 2016-07-20 EP disclosed
US-6054501-A CURABILITY; GLOSSINESS; CAN BE BLENDED WITH INKS, PAINTS NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2000-04-25 US disclosed
EP-0844255-A1 PHOTOPOLYMERIZATION INITIATOR AND ACTINIC RADIATION-CURABLE COMPOSITION COMPRISING THE SAME NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1998-05-27 EP disclosed
EP-0629613-B1 Novel onium salt, photopolymerization initiator, energy ray-curing composition containing the initiator, and cured product NIPPON KAYAKU KK (JP) 1997-10-15 EP disclosed
US-5534557-A COATINGS NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1996-07-09 US disclosed
US-5502083-A SULFONIUM CATALYST NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1996-03-26 US disclosed
EP-0629613-A2 Novel onium salt, photopolymerization initiator, energy ray-curing composition containing the initiator, and cured product NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1994-12-21 EP disclosed
EP-0279217-B1 PROCESS FOR THE PREPARATION OF POLY(ARYLENSULFIDES) WITH ADJUSTABLE MELT VISCOSITY BAYER AG (DE) 1992-03-11 EP disclosed