SCHEMBL3267386

SCHEMBL3267386

C#CNC(=O)Nc1ccccc1Cl

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.59
KDM4E B2RXH2 3/20 0.56
MEN1 O00255 6/20 0.54
KMT2A Q03164 6/20 0.54
MAPT P10636 5/20 0.54
RAB9A P51151 5/20 0.54
NPC1 O15118 4/20 0.54
POLB P06746 2/20 0.54
LMNA P02545 2/20 0.54
GAA P10253 2/20 0.54
MAPK1 P28482 2/20 0.54
NPSR1 Q6W5P4 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
HTT P42858 2/20 0.54
CASP3 P42574 1/20 0.54
SENP8 Q96LD8 1/20 0.54
SENP7 Q9BQF6 1/20 0.54
SENP6 Q9GZR1 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
HPGD P15428 2/20 0.53

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
SCHEMBL10458447 0.84 KDM4E (0.72) CYP1A2KDM4EMEN1KMT2AMAPT
SCHEMBL11449284 0.79 CYP1A2 (0.65) CYP1A2KDM4EMEN1KMT2AMAPT
SCHEMBL8830517 0.77 SMN1; SMN2 (0.73) CYP1A2KDM4EMEN1KMT2AMAPT
SCHEMBL8421117 0.77 CYP1A2 (0.62) CYP1A2KDM4EMEN1KMT2AMAPT
SCHEMBL9036644 0.77 CYP1A2 (0.68) CYP1A2KDM4EMEN1KMT2AMAPT
SCHEMBL2877144 0.77 CYP1A2 (0.56) CYP1A2KDM4EMEN1KMT2AMAPT
SCHEMBL6859262 0.76 CYP1A2 (0.64) CYP1A2KDM4EMEN1KMT2AMAPT
SCHEMBL1700678 0.76 MEN1 (0.87) CYP1A2KDM4EMEN1KMT2AMAPT
Hydrochloric Acid SCHEMBL5119113 0.76 CYP1A2 (0.66) CYP1A2KDM4EMEN1KMT2AMAPT
SCHEMBL3264574 0.75 SMN1; SMN2 (0.64) KDM4EMEN1KMT2AMAPTRAB9A

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
EP-1776347-B1 SULPHONAMIDE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI AVENTIS (FR) 2010-05-26 EP disclosed