SCHEMBL24762928

SCHEMBL24762928

O=CN1CCN(C2(c3ccc(SCc4ccccc4)cc3)CC2)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.40
▸ LMNA P02545 2/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ LTA4H P09960 2/20 0.39
▸ MAOA P21397 3/20 0.38
▸ MAOB P27338 3/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ ALOX5 P09917 1/20 0.38
▸ PTGS1 P23219 1/20 0.38
▸ SLC6A4 P31645 2/20 0.37
▸ ELANE P08246 1/20 0.37
▸ GRIN2D O15399 1/20 0.37
▸ GRIN3B O60391 1/20 0.37
▸ CYP2B6 P20813 1/20 0.37
▸ SLC6A2 P23975 1/20 0.37
▸ PRCP P42785 1/20 0.37

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
SCHEMBL24762050 0.79 LMNA (0.41) ALDH1A1LMNASMN1; SMN2NPC1HPGD
SCHEMBL24762180 0.73 PKM (0.51) ALDH1A1LMNASMN1; SMN2NPC1MEN1
SCHEMBL24763412 0.69 LMNA (0.39) ALDH1A1LMNASMN1; SMN2NPC1HPGD
SCHEMBL9461363 0.68 GRIN1 (0.69) SLC6A4GRIN2DGRIN3BCYP2B6SLC6A2
SCHEMBL332623 0.68 MAOA (0.63) ALDH1A1LMNASMN1; SMN2NPC1HPGD
Cyclohexane SCHEMBL28084543 0.66 MAOA (0.57) ALDH1A1LMNASMN1; SMN2NPC1HPGD
SCHEMBL28084553 0.66 MAOA (0.61) ALDH1A1LMNASMN1; SMN2NPC1HPGD
SCHEMBL510481 0.66 MAOA (0.53) ALDH1A1LTA4HMAOAMAOBMEN1
SCHEMBL16111935 0.65 SIGMAR1 (0.62) LMNASLC6A4GRIN2DGRIN3BCYP2B6
SCHEMBL31713446 0.65 MAOA (0.45) ALDH1A1LMNASMN1; SMN2NPC1HPGD

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
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