SCHEMBL9637010

SCHEMBL9637010

[O-][S+](c1ccc(Cl)cc1)c1ccc(Sc2ccc([S+]([O-])c3ccc(Cl)cc3)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.47
MAOB P27338 3/20 0.47
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
CHRNA7 P36544 1/20 0.39
HAO1 Q9UJM8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
RHEB Q15382 2/20 0.37
MAPT P10636 2/20 0.37
NPC1 O15118 1/20 0.37
HTT P42858 1/20 0.37
RAB9A P51151 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
LMNA P02545 1/20 0.36
CYP2A6 P11509 1/20 0.36
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 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
SCHEMBL9635796 0.85 LMNA (0.50) MEN1KMT2AL3MBTL1LMNACYP2A6
SCHEMBL548628 0.85 LMNA (0.50) MEN1KMT2AL3MBTL1LMNACYP2A6
SCHEMBL9637022 0.85 LMNA (0.50) MEN1KMT2AL3MBTL1LMNACYP2A6
SCHEMBL10225007 0.81 MAOA (0.50) MAOAMAOBMEN1KMT2ACHRNA7
SCHEMBL9476350 0.80 MAOA (0.64) MAOAMAOBMEN1KMT2ACHRNA7
SCHEMBL9475224 0.80 MAOA (0.64) MAOAMAOBMEN1KMT2ACHRNA7
SCHEMBL481976 0.80 MAOA (0.64) MAOAMAOBMEN1KMT2ACHRNA7
SCHEMBL9275867 0.79 MAOA (0.45) MAOAMAOBCHRNA7MAPTALDH1A1
SCHEMBL9637222 0.78 CYP1A2 (0.48) MAOBMEN1KMT2AL3MBTL1NPC1
SCHEMBL197577 0.78 CYP1A2 (0.48) MAOBMEN1KMT2AL3MBTL1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5144004-A Heat resistance, selective degradation, reaction of halogen substituted sulfones and sulfoxides and alkali metal sulfides PHILLIPS PETROLEUM COMPANY (US) 1992-09-01 US disclosed