SCHEMBL11838989

SCHEMBL11838989

CC(=O)Nc1ccccc1NS(=O)(=O)c1cc(C(=O)O)c(NCc2ccoc2)cc1Oc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ CISD1 Q9NZ45 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ PKM P14618 1/20 0.37
▸ CYP2C9 P11712 2/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ APP P05067 2/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ TNF P01375 1/20 0.35
▸ NOD2 Q9HC29 1/20 0.35
▸ NOD1 Q9Y239 1/20 0.35
▸ GAA P10253 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
SCHEMBL11844344 0.88 CISD1 (0.41) MEN1KMT2ACISD1CYP2C9CYP1A2
SCHEMBL11796943 0.84 BRAF (0.37) MEN1KMT2ACISD1APPLMNA
SCHEMBL11777207 0.83 SIRT2 (0.39) MEN1KMT2ACISD1NPC1RAB9A
SCHEMBL11788087 0.83 CISD1 (0.53) CISD1CYP2C9LMNATSHRALDH1A1
SCHEMBL11802842 0.76 CISD1 (0.47) CISD1APPALDH1A1
SCHEMBL11842089 0.72 LMNA (0.51) MEN1KMT2APKMLMNATSHR
Acetanilide SCHEMBL11798783 0.72 CISD1 (0.49) CISD1APPALDH1A1
SCHEMBL11705514 0.71 CISD1 (0.67) MEN1KMT2ACISD1CYP2C9LMNA
SCHEMBL11820413 0.70 CISD1 (0.45) MEN1KMT2ACISD1APPTSHR
SCHEMBL11781753 0.70 CISD1 (0.41) CISD1APPSMN1; SMN2ALDH1A1

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-3939267-A DIURETIC CIBA-GEIGY CORPORATION (US) 1976-02-17 — — US disclosed
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