SCHEMBL14068043

SCHEMBL14068043

CCc1ccccc1CN(C)S(=O)(=O)c1cccc(CNCc2ccccc2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
POLB P06746 2/20 0.43
ALDH1A1 P00352 5/20 0.43
HTT P42858 2/20 0.43
HPGD P15428 1/20 0.43
KDM4E B2RXH2 2/20 0.42
PKM P14618 1/20 0.42
MAPK1 P28482 1/20 0.42
LMNA P02545 2/20 0.41
HTR2C P28335 1/20 0.41
NPC1 O15118 1/20 0.41
TNF P01375 1/20 0.41
RAB9A P51151 1/20 0.41
NOD1 Q9Y239 1/20 0.41
ADRB2 P07550 1/20 0.41
MAPT P10636 1/20 0.41
MAOA P21397 1/20 0.41
CASP3 P42574 1/20 0.41
RXFP1 Q9HBX9 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
SCHEMBL14025560 0.88 ALDH1A1 (0.53) MEN1KMT2APOLBALDH1A1HTT
SCHEMBL14068058 0.88 NAMPT (0.48) ALDH1A1HTTMAPK1LMNANPC1
SCHEMBL15676806 0.78 ALDH1A1 (0.57) MEN1KMT2APOLBALDH1A1HTT
SCHEMBL14025570 0.78 CASP3 (0.49) MEN1KMT2APOLBALDH1A1HTT
SCHEMBL14025574 0.77 TAAR1 (0.44) MEN1KMT2APOLBALDH1A1HTT
SCHEMBL14025548 0.76 PKM (0.53) MEN1KMT2APOLBALDH1A1HTT
SCHEMBL14025567 0.75 HTT (0.53) POLBALDH1A1HTTKDM4ELMNA
SCHEMBL14068310 0.75 DRD2 (0.55) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL14025576 0.75 ITGB3 (0.51) MEN1KMT2APOLBALDH1A1HTT
SCHEMBL14025577 0.75 HTT (0.50) MEN1KMT2AALDH1A1HTTMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008109154-A1 CHEMOKINE RECEPTOR MODULATORS ALTIRIS THERAPEUTICS, INC. (US) 2008-09-12 WO disclosed