SCHEMBL9727392

SCHEMBL9727392

O=C1CCCN1S(=O)(=O)c1ccc(C2CCCC2)cc1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.59
HTT P42858 1/20 0.59
SMN1; SMN2 Q16637 3/20 0.54
APOBEC3A P31941 1/20 0.52
APOBEC3G Q9HC16 1/20 0.52
TSHR P16473 3/20 0.51
STAT3 P40763 1/20 0.51
RAB9A P51151 1/20 0.51
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
THRB P10828 1/20 0.44
AKR1C3 P42330 6/20 0.44
TP53 P04637 1/20 0.44
KDM2B Q8NHM5 1/20 0.43
GAA P10253 1/20 0.43
BRD4 O60885 1/20 0.43
PKM P14618 1/20 0.42

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
SCHEMBL9727442 0.98 LMNA (0.61) LMNAHTTSMN1; SMN2APOBEC3AAPOBEC3G
SCHEMBL9727309 0.88 HTR6 (0.49) LMNAHTTSMN1; SMN2APOBEC3AAPOBEC3G
SCHEMBL9727306 0.80 LMNA (0.41) LMNAHTTSMN1; SMN2APOBEC3AAPOBEC3G
SCHEMBL7379601 0.78 MMP2 (0.64) LMNASMN1; SMN2MEN1KMT2AAKR1C3
SCHEMBL10702282 0.78 MMP2 (0.64) KMT2AAKR1C3TP53GAAPKM
SCHEMBL7383735 0.78 MMP2 (0.64) LMNAHTTSMN1; SMN2MEN1KMT2A
SCHEMBL7380549 0.77 PKM (0.62) LMNAMEN1KMT2AAKR1C3TP53
SCHEMBL9797182 0.74 AKR1C3 (0.56) LMNAHTTSMN1; SMN2AKR1C3TP53
SCHEMBL9727563 0.74 AKR1C3 (0.56) LMNAHTTSMN1; SMN2AKR1C3TP53
SCHEMBL9727293 0.74 TP53 (0.59) LMNATP53KDM2BGAA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5164514-A Antispasmodics ROUSSEL UCLAF (FR) 1992-11-17 US disclosed
US-5081130-A Antispasmodic agents ROUSSEL UCLAF (FR) 1992-01-14 US disclosed
US-4990531-A Antispasmodic agents ROUSSEL UCLAF (FR) 1991-02-05 US disclosed
EP-0335758-A2 Derivatives of 1-arylsulfonyl-2-pyrolidinone, process for their preparation, their use as medicaments and compositions containing them ROUSSEL-UCLAF (FR) 1989-10-04 EP disclosed