SCHEMBL8573956

SCHEMBL8573956

CCCCCCS(=O)(=O)N(Cc1ccc(-c2ccc(Cl)cc2)cc1)N1CCNCC1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPKAPK2 P49137 5/20 0.39
▸ CNR2 P34972 3/20 0.38
▸ LSS P48449 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ MLNR O43193 1/20 0.35
▸ PSEN1 P49768 1/20 0.35
▸ PSEN2 P49810 1/20 0.35
▸ APH1B Q8WW43 1/20 0.35
▸ NCSTN Q92542 1/20 0.35
▸ APH1A Q96BI3 1/20 0.35
▸ PSENEN Q9NZ42 1/20 0.35
▸ SCN5A Q14524 1/20 0.34
▸ SCN2A Q99250 1/20 0.34
▸ SCN10A Q9Y5Y9 1/20 0.34
▸ CETP P11597 1/20 0.34
▸ KCNH2 Q12809 2/20 0.33
▸ THRB P10828 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
SCHEMBL8573952 0.68 CHIT1 (0.35) MAPKAPK2MLNR
SCHEMBL8571349 0.68 CHIT1 (0.34) MAPKAPK2MLNR
SCHEMBL6412306 0.64 BMP1 (0.54) CNR2MAPT
Octane SCHEMBL10612108 0.64 KCNH2 (0.51) CNR2LSSKCNH2
SCHEMBL10669758 0.62 LSS (0.62) LSS
SCHEMBL25420992 0.62 GNAO1 (0.43) MAPTTHRB
SCHEMBL25253971 0.62 GNAO1 (0.43) MAPTTHRB
SCHEMBL25420232 0.62 GNAO1 (0.43) MAPTTHRB
SCHEMBL10464788 0.62 GNAO1 (0.43) MAPTTHRB
SCHEMBL11620858 0.62 HRH3 (0.53) —

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-5716950-A NONTOXIC ANTIALLERGEN AND ANTIASTHMATIC HAVING LOW ANTIHISTAMINIC SIDE EFFECTS NIPPON SHOJI KABUSHIKI KAISHA (JP) 1998-02-10 — — US disclosed
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