SCHEMBL9513736

SCHEMBL9513736

CS(=O)(=O)Nc1ccc(C(=O)CN2CCN(c3ccncc3)CC2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.49
GAA P10253 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
HRH3 Q9Y5N1 4/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
GRIN2B Q13224 1/20 0.46
ADRB2 P07550 3/20 0.45
ADRB1 P08588 3/20 0.45
ADRB3 P13945 3/20 0.45
ESRRG P62508 3/20 0.44
ESRRB O95718 1/20 0.44
ESR1 P03372 1/20 0.44
ESRRA P11474 1/20 0.44
KCNH2 Q12809 1/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
TSHR P16473 1/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 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
SCHEMBL10359739 0.92 POLB (0.57) POLBGAATDP1MEN1KMT2A
SCHEMBL9517111 0.90 HRH3 (0.49) POLBGAATDP1HRH3MEN1
SCHEMBL10577329 0.89 KMT2A (0.53) HRH3MEN1KMT2AESRRGESRRB
SCHEMBL9515021 0.87 NAMPT (0.51) POLBGAATDP1HRH3GRIN2B
SCHEMBL9514727 0.86 POLB (0.43) POLBGAATDP1MEN1KMT2A
SCHEMBL7400525 0.85 MEN1 (0.55) POLBTDP1MEN1KMT2AKDM4E
SCHEMBL7398399 0.85 LMNA (0.51) POLBGAATDP1HRH3MEN1
SCHEMBL9514755 0.84 GRIN2B (0.43) POLBGAATDP1MEN1KMT2A
SCHEMBL9513484 0.83 POLB (0.56) POLBGAATDP1HRH3MEN1
SCHEMBL7393630 0.83 POLB (0.48) POLBGAATDP1HRH3MEN1

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-0233051-B1 ANTIARRHYTHMIC AGENTS Pfizer Limited (GB) 1993-09-15 EP 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