SCHEMBL8779800

SCHEMBL8779800

ClC(Cl)Sc1ccc(Sc2ccccc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.45
MAOB P27338 3/20 0.45
CHRNA7 P36544 1/20 0.44
SLC6A4 P31645 1/20 0.42
HPGD P15428 2/20 0.42
ALDH1A1 P00352 1/20 0.42
BCL2 P10415 1/20 0.39
MCL1 Q07820 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
MAPT P10636 1/20 0.38
MGLL Q99685 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MAPK1 P28482 2/20 0.36
POLB P06746 1/20 0.36
PTGIR P43119 1/20 0.36
MMP8 P22894 1/20 0.36
MMP13 P45452 1/20 0.36
TSHR P16473 2/20 0.35
NR1H2 P55055 1/20 0.35
CYP3A4 P08684 1/20 0.35

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
SCHEMBL8779780 0.90 NR1H2 (0.41) MAOAMAOBCHRNA7SLC6A4HPGD
SCHEMBL3911663 0.90 SMN1; SMN2 (0.45) MAOAMAOBHPGDALDH1A1SMN1; SMN2
SCHEMBL8484321 0.90 CHRNA7 (0.39) MAOAMAOBCHRNA7SLC6A4HPGD
SCHEMBL14894782 0.87 SMN1; SMN2 (0.43) MAOAMAOBHPGDALDH1A1SMN1; SMN2
SCHEMBL8779795 0.82 CYP2C9 (0.37) HSD17B10MMP8
SCHEMBL23277364 0.79 MAOA (0.62) MAOAMAOBCHRNA7SLC6A4HPGD
SCHEMBL3891151 0.79 MAOA (0.62) MAOAMAOBCHRNA7SLC6A4HPGD
SCHEMBL3891569 0.79 MAOA (0.62) MAOAMAOBCHRNA7SLC6A4HPGD
SCHEMBL795030 0.79 MAOA (0.62) MAOAMAOBCHRNA7SLC6A4HPGD
SCHEMBL19391185 0.76 SLC6A4 (0.52) MAOAMAOBCHRNA7SLC6A4HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0770599-A1 PROCESS FOR THE PREPARATION OF AROMATIC OR HETEROAROMATIC SULFONYL HALIDES SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 1997-05-02 EP disclosed
EP-0742201-A1 PROCESS FOR PRODUCING AROMATIC OR HETEROAROMATIC SULFUR COMPOUNDS SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 1996-11-13 EP disclosed