SCHEMBL24762200

SCHEMBL24762200

O=C(N1CCN(Sc2cccc(SCc3ccccc3)c2)CC1)C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.42
▸ KMT2A Q03164 3/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ ALDH1A1 P00352 4/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ MAPT P10636 2/20 0.40
▸ CHRM1 P11229 3/20 0.39
▸ CHRM4 P08173 1/20 0.39
▸ CHRM5 P08912 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ MCL1 Q07820 2/20 0.37
▸ PKM P14618 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ MAOA P21397 1/20 0.36
▸ MAOB P27338 1/20 0.36
▸ PPARG P37231 1/20 0.36
▸ PPARA Q07869 1/20 0.36

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
SCHEMBL27238588 0.80 GAA (0.57) LMNAKMT2AMEN1ALDH1A1NPC1
SCHEMBL29764383 0.80 GAA (0.57) LMNAKMT2AMEN1ALDH1A1NPC1
SCHEMBL29764384 0.80 GAA (0.57) LMNAKMT2AMEN1ALDH1A1NPC1
SCHEMBL24762918 0.78 ALDH1A1 (0.43) LMNAKMT2AALDH1A1HPGDMAPT
SCHEMBL24762923 0.74 PKM (0.50) LMNAKMT2AMEN1ALDH1A1NPC1
SCHEMBL29764466 0.74 PKM (0.50) LMNAKMT2AMEN1ALDH1A1NPC1
SCHEMBL24762182 0.74 PKM (0.55) LMNAKMT2AALDH1A1NPC1GAA
SCHEMBL16935105 0.74 ESR1 (0.57) LMNAKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL24762050 0.73 LMNA (0.41) LMNAKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL29764350 0.72 MAOA (0.48) LMNAKMT2AALDH1A1MAPTGAA

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
WO-2022169755-A1 SULFONAMIDE SUBSTITUTED N-(1H-INDOL-7-YL) BENZENESULFONAMIDES AND USES THEREOF TRIANA BIOMEDICINES, INC. (US) 2022-08-11 — — WO disclosed
Send feedback