SCHEMBL9224604

SCHEMBL9224604

CS(=O)(=O)Nc1ccc(C(O)CCN2CCN(c3ccncc3)CC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 2/20 0.51
ADRB2 P07550 6/20 0.48
ADRB1 P08588 6/20 0.48
ADRB3 P13945 6/20 0.48
HTR1A P08908 7/20 0.47
KCNH2 Q12809 1/20 0.46
LMNA P02545 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
KDM4E B2RXH2 1/20 0.44
GLA P06280 1/20 0.44
BLM P54132 1/20 0.44

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
SCHEMBL6375438 0.89 SPHK1 (0.60) SPHK1ADRB2ADRB1ADRB3KCNH2
SCHEMBL9225437 0.81 LMNA (0.56) ADRB2ADRB1ADRB3HTR1AKCNH2
SCHEMBL9514747 0.81 HTR1A (0.58) HTR1AKCNH2LMNA
SCHEMBL10561148 0.80 ADRB2 (0.62) SPHK1ADRB2ADRB1ADRB3KCNH2
SCHEMBL10680323 0.79 JAK2 (0.50) ADRB2ADRB1ADRB3KCNH2LMNA
SCHEMBL10577329 0.79 KMT2A (0.53) HTR1AMEN1KMT2A
SCHEMBL10578945 0.79 SPHK1 (0.62) SPHK1ADRB2ADRB1ADRB3HTR1A
SCHEMBL9513748 0.78 JAK2 (0.51) ADRB2ADRB1ADRB3HTR1AKCNH2
SCHEMBL10580782 0.77 SPHK1 (0.57) SPHK1ADRB2ADRB1ADRB3HTR1A
SCHEMBL9513791 0.77 ADRB2 (0.51) SPHK1ADRB2ADRB1ADRB3KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5405997-A Stable against rapid metabolism THE UPJOHN COMPANY (US) 1995-04-11 US disclosed
EP-0484378-B1 ANTIARRHYTHMIC TERTIARY AMINE-ALKENYL-PHENYL-ALKANESULFONAMIDES UPJOHN CO (US) 1994-09-14 EP disclosed
EP-0484378-A1 ANTIARRHYTHMIC TERTIARY AMINE-ALKENYL-PHENYL-ALKANESULFONAMIDES. UPJOHN CO (US) 1992-05-13 EP disclosed
WO-1991001299-A1 ANTIARRHYTHMIC TERTIARY AMINE-ALKENYL-PHENYL-ALKANESULFONAMIDES THE UPJOHN COMPANY (US) 1991-02-07 WO disclosed
US-4806536-A Piperazinyl-substituted pyridine and imidazole anti-arrhythmic agents PFIZER, INC. (US) 1989-02-21 US disclosed
EP-0233051-A2 Antiarrhythmic Agents Pfizer Limited (GB) 1987-08-19 EP disclosed