SCHEMBL9670487

SCHEMBL9670487

CS(=O)(=O)Nc1ccccc1C(=O)NCC1CNCCN1c1ccccc1

nearest known ligand 0.74

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ADRB1 P08588 3/20 0.74
KDM4E B2RXH2 10/20 0.47
ALDH1A1 P00352 9/20 0.47
HPGD P15428 6/20 0.47
HSD17B10 Q99714 6/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
PKM P14618 1/20 0.46
SLC6A2 P23975 2/20 0.46
SLC6A4 P31645 2/20 0.46
SLC6A3 Q01959 2/20 0.46
RCE1 Q9Y256 1/20 0.45
PRMT5 O14744 1/20 0.43
WDR77 Q9BQA1 1/20 0.43
TSHR P16473 3/20 0.43
GAA P10253 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 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
SCHEMBL9593901 0.85 ADRB1 (1.00) ADRB1KDM4EALDH1A1SMN1; SMN2SLC6A2
SCHEMBL9596252 0.78 ADRB1 (1.00) ADRB1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL9670493 0.70 ADRB1 (0.56) ADRB1SLC6A2SLC6A4SLC6A3KMT2A
SCHEMBL24918358 0.70 SLC6A4 (0.64) ADRB1SLC6A2SLC6A4SLC6A3
SCHEMBL25154499 0.70 SLC6A4 (0.64) ADRB1SLC6A2SLC6A4SLC6A3
SCHEMBL25154293 0.70 SLC6A4 (0.64) ADRB1SLC6A2SLC6A4SLC6A3
SCHEMBL7149297 0.68 SLC6A2 (0.69) ADRB1SLC6A2SLC6A4SLC6A3
SCHEMBL21360403 0.68 SLC6A4 (0.69) ADRB1SLC6A2SLC6A4SLC6A3
SCHEMBL20141290 0.68 SLC6A4 (0.69) ADRB1SLC6A2SLC6A4SLC6A3
SCHEMBL20140560 0.68 SLC6A4 (0.69) ADRB1SLC6A2SLC6A4SLC6A3

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-0491709-A1 2-SUBSTITUTED-1(4)-ARYL PIPERAZINES AND THE PROCESS FOR THEIR PREPARATION SCHERING AKTIENGESELLSCHAFT (DE) 1992-07-01 EP disclosed
WO-1991004250-A1 2-SUBSTITUTED-1(4)-ARYL PIPERAZINES AND THE PROCESS FOR THEIR PREPARATION SCHERING AKTIENGESELLSCHAFT BERLIN UND BERGKAMEN (DE) 1991-04-04 WO disclosed