SCHEMBL6986513

SCHEMBL6986513

N#Cc1ccccc1S(=O)(=O)NCc1cnc[nH]1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.45
TAAR1 Q96RJ0 1/20 0.43
SLC40A1 Q9NP59 1/20 0.43
KMT2A Q03164 1/20 0.41

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
SCHEMBL6987058 0.76 SMN1; SMN2 (0.58) ADRA1ASMN1; SMN2TAAR1
SCHEMBL6985668 0.75 KMT2A (0.62) SMN1; SMN2KMT2A
SCHEMBL5002972 0.71 ALDH1A1 (0.53) SLC40A1KMT2A
SCHEMBL7956237 0.69 GAA (0.44) SMN1; SMN2KMT2A
SCHEMBL6071694 0.68 KDM4E (0.49) ADRA1ATAAR1
SCHEMBL6986013 0.67 CYP11B1 (0.53)
SCHEMBL1145362 0.67 ALDH1A1 (0.54) SMN1; SMN2SLC40A1KMT2A
SCHEMBL6238697 0.66 ALDH1A1 (0.53) SLC40A1KMT2A
SCHEMBL8224003 0.66 ALDH1A1 (0.53) SLC40A1KMT2A
SCHEMBL13211030 0.66 ALDH1A1 (0.58) SLC40A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1324999-A1 NOVEL AMINOPHENYL PIPERAZINE OR AMINOPHENYL PIPERIDINE DERIVATIVES INHIBITING PRENYL TRANSFERASE PROTEINS AND METHODS FOR PREPARING SAME PIERRE FABRE MEDICAMENT (FR) 2003-07-09 EP disclosed
WO-2002030927-A1 NOVEL AMINOPHENYL PIPERAZINE OR AMINOPHENYL PIPERIDINE DERIVATIVES INHIBITING PRENYL TRANSFERASE PROTEINS AND METHODS FOR PREPARING SAME PIERRE FABRE MEDICAMENT (FR) 2002-04-18 WO disclosed