SCHEMBL9828015

SCHEMBL9828015

NS(=O)(=O)c1ccc(C2CCN(c3ccncc3)CC2)cc1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 7/20 0.50
CA1 P00915 3/20 0.50
CA2 P00918 3/20 0.50
CA12 O43570 2/20 0.50
CA9 Q16790 2/20 0.50
TP53 P04637 3/20 0.49
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48
CA7 P43166 1/20 0.47
CA14 Q9ULX7 1/20 0.47
LSS P48449 2/20 0.43
CHKA P35790 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
SCHEMBL10680303 0.83 CA2 (0.66) CHRNA7CA1CA2CA12CA9
SCHEMBL8343036 0.82 CA1 (0.63) CA1CA2CA12CA9KDM4E
SCHEMBL9827177 0.82 TP53 (0.46) TP53KDM4EALDH1A1LMNALSS
SCHEMBL9828388 0.80 CHKA (0.48) TP53KDM4EALDH1A1LMNACHKA
SCHEMBL9827139 0.77 POLB (0.54) ALDH1A1LMNA
SCHEMBL9828313 0.77 JAK2 (0.47) TP53ALDH1A1LMNACHKA
SCHEMBL9827723 0.76 CHRNA7 (0.48) CHRNA7CA1CA2CA12CA9
SCHEMBL8323422 0.76 CA2 (0.52) CHRNA7CA1CA2CA12CA9
SCHEMBL9828971 0.74 CA2 (0.42) CHRNA7CA1CA2CA12CA9
SCHEMBL16966466 0.73 ALDH1A1 (0.62) CA1CA2CA12CA9KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0291210-B1 ANTIARRHYTHMIC AGENTS Pfizer Limited (GB) 1991-11-06 EP disclosed
US-4835165-A Antiarrhythmic 4-phenylpiperidines PFIZER INC. (US) 1989-05-30 US disclosed
EP-0291210-A1 Antiarrhythmic agents Pfizer Limited (GB) 1988-11-17 EP disclosed