SCHEMBL8760671

SCHEMBL8760671

CS(=O)(=O)NC1CNCCN1C(=O)Nc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.49
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ADRB1 P08588 2/20 0.42
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ALOX15 P16050 1/20 0.41
LMNA P02545 1/20 0.40
CHRNA7 P36544 2/20 0.40

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
Hydrochloric Acid SCHEMBL3713052 0.78 POLB (0.58) POLBNPC1RAB9ASMN1; SMN2GAA
SCHEMBL3721248 0.77 POLB (0.60) POLBNPC1RAB9ASMN1; SMN2GAA
SCHEMBL4592734 0.77 POLB (0.56) POLBNPC1RAB9ASMN1; SMN2GAA
SCHEMBL14698727 0.76 POLB (0.52) POLBNPC1RAB9ASMN1; SMN2GAA
SCHEMBL5190567 0.72 POLB (0.50) POLBMEN1KMT2ACHRNA7
SCHEMBL17372632 0.71 POLB (0.49) POLBNPC1RAB9ASMN1; SMN2GAA
SCHEMBL4725610 0.68 P2RX7 (0.55) POLBNPC1RAB9ASMN1; SMN2GAA
SCHEMBL656655 0.68 POLB (0.97) POLBNPC1RAB9ASMN1; SMN2GAA
Hydrochloric Acid SCHEMBL28769179 0.68 POLB (0.45) POLBCHRNA7
SCHEMBL7504156 0.67 POLB (0.93) POLBNPC1RAB9ASMN1; SMN2GAA

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-0773937-A1 NOVEL ARYL PIPERAZINE-DERIVED PIPERAZIDE DERIVATIVES, METHODS FOR THEIR PREPARATION, THEIR USE AS DRUGS AND PHARMACEUTICAL COMPOSITIONS COMPRISING SAME PIERRE FABRE MEDICAMENT (FR) 1997-05-21 EP disclosed
WO-1996002525-A1 NOVEL ARYL PIPERAZINE-DERIVED PIPERAZIDE DERIVATIVES, METHODS FOR THEIR PREPARATION, THEIR USE AS DRUGS AND PHARMACEUTICAL COMPOSITIONS COMPRISING SAME PIERRE FABRE MEDICAMENT (FR) 1996-02-01 WO disclosed