SCHEMBL11014076

SCHEMBL11014076

CC(C)N(C(C)C)S(=O)(=O)c1ccc([C]=O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.47
▸ ALDH1A1 P00352 3/20 0.44
▸ MAPT P10636 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ VCAM1 P19320 1/20 0.42
▸ LMNA P02545 3/20 0.40
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ AGER Q15109 1/20 0.35
▸ ESR1 P03372 1/20 0.35
▸ HTT P42858 2/20 0.34
▸ TAS2R14 Q9NYV8 1/20 0.34
▸ MCOLN3 Q8TDD5 1/20 0.33
▸ GLA P06280 1/20 0.33
▸ ADAM17 P78536 1/20 0.33
▸ CA12 O43570 1/20 0.33
▸ CA1 P00915 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
SCHEMBL5805726 0.79 LMNA (0.55) SMN1; SMN2ALDH1A1MAPTKDM4EVCAM1
SCHEMBL2936178 0.75 SMN1; SMN2 (0.50) SMN1; SMN2ALDH1A1MAPTKDM4EGAA
SCHEMBL12989147 0.75 SMN1; SMN2 (0.50) SMN1; SMN2ALDH1A1MAPTKDM4EGAA
SCHEMBL2332262 0.75 SMN1; SMN2 (0.59) SMN1; SMN2ALDH1A1MAPTKDM4EGAA
SCHEMBL11135901 0.75 TSHR (0.50) SMN1; SMN2ALDH1A1MAPTKDM4EGAA
SCHEMBL7974837 0.74 LMNA (0.66) SMN1; SMN2ALDH1A1MAPTLMNAMEN1
SCHEMBL4613713 0.74 APOBEC3G (0.54) SMN1; SMN2ALDH1A1MAPTKDM4EGAA
Hydrochloric Acid SCHEMBL28541249 0.72 APOBEC3G (0.52) SMN1; SMN2ALDH1A1MAPTKDM4EGAA
SCHEMBL11014092 0.72 SMN1; SMN2 (0.47) SMN1; SMN2ALDH1A1MAPTKDM4EGAA
SCHEMBL28109405 0.72 CA12 (0.58) SMN1; SMN2ALDH1A1MAPTGAALMNA

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-4508723-A 6-Azaoligocycloalkylmethyleneaminopenam compounds CIBA GEIGY CORPORATION (US) 1985-04-02 — — US disclosed
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