SCHEMBL9625224

SCHEMBL9625224

CCCCCCC(CC)NC(=O)Cc1ccc(N)cc1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.54
CNR2 P34972 3/20 0.53
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
KDM4E B2RXH2 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
PDE4A P27815 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HIF1A Q16665 1/20 0.43
HDAC10 Q969S8 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
POLB P06746 1/20 0.43
MAPT P10636 2/20 0.40
HPGD P15428 1/20 0.40
ALDH1A1 P00352 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 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
SCHEMBL8695595 0.86 CNR2 (0.72) TDP1CNR2KMT2AMEN1POLB
SCHEMBL1856691 0.78 CNR2 (0.72) CNR2KMT2AMEN1POLB
SCHEMBL1852549 0.78 CNR2 (0.72) CNR2KMT2AMEN1POLB
SCHEMBL31616456 0.77 CNR2 (0.70) CNR2KMT2AMEN1POLB
SCHEMBL24244093 0.75 CNR2 (0.44) TDP1CNR2KMT2AMEN1KDM4E
SCHEMBL7193360 0.74 CNR1 (0.51) TDP1CNR2KMT2AMEN1ALDH1A1
SCHEMBL8626174 0.74 MEN1 (0.50) TDP1CNR2KMT2AMEN1KDM4E
SCHEMBL18896343 0.74 POLB (0.69) TDP1CNR2KMT2AMEN1CYP1A2
SCHEMBL11045634 0.73 HTR2A (0.44) KMT2AMEN1KDM4ESMN1; SMN2HIF1A
SCHEMBL7828211 0.73 PLA2G2C (0.63) KMT2AMEN1

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
US-5155268-A Antiarrhythmic N-aminoalkylene alkyl and aryl sulfonamides THE UPJOHN COMPANY (US) 1992-10-13 US disclosed
EP-0164865-B1 N-(AMINOALKYLPHENYL)SULFONAMIDES THEIR PREPARATION AND THERAPEUTIC USE THE UPJOHN COMPANY (US) 1988-12-21 EP disclosed
EP-0164865-A1 N-(Aminoalkylphenyl)sulfonamides their preparation and therapeutic use THE UPJOHN COMPANY (US) 1985-12-18 EP disclosed