SCHEMBL5823007

SCHEMBL5823007

NC(=O)N(S)c1ccc2cn[nH]c2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.47
KDM4E B2RXH2 1/20 0.47
MEN1 O00255 1/20 0.47
PKM P14618 1/20 0.47
HTT P42858 1/20 0.47
KMT2A Q03164 1/20 0.47
INSR P06213 1/20 0.47
IGF1R P08069 1/20 0.47
NEK2 P51955 1/20 0.45
NOS1 P29475 3/20 0.44
DYRK1A Q13627 3/20 0.44
METAP2 P50579 2/20 0.44
FGFR1 P11362 4/20 0.43
FGFR2 P21802 2/20 0.43
FGFR3 P22607 1/20 0.43
CYP3A4 P08684 2/20 0.42
LMNA P02545 1/20 0.42
ALOX15 P16050 1/20 0.42
AR P10275 1/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL5823141 0.88 ROCK2 (0.47) MAPTKDM4EMEN1KMT2ANEK2
SCHEMBL28922588 0.76 LCK (0.35) MAPTMEN1KMT2AALDH1A1LCK
SCHEMBL29887527 0.72 AR (0.63) MAPTKDM4EMEN1PKMHTT
SCHEMBL475069 0.72 AR (0.63) MAPTKDM4EMEN1PKMHTT
SCHEMBL14137873 0.72 NOS1 (0.53) MAPTKDM4EMEN1PKMHTT
Hydrochloric Acid SCHEMBL31173861 0.71 AR (0.61) MAPTKDM4EMEN1PKMHTT
Hydrochloric Acid SCHEMBL6999702 0.71 AR (0.61) MAPTKDM4EMEN1PKMHTT
SCHEMBL27925326 0.71 TRPV1 (0.43) MAPTKDM4EMEN1PKMHTT
SCHEMBL651823 0.70 ESR1 (0.42) MAPTKDM4EMEN1PKMHTT
Hydrochloric Acid SCHEMBL29176224 0.70 NOS1 (0.52) MAPTKDM4EMEN1PKMHTT

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-2006135383-A2 INDAZOLES MYRIAD GENETICS, INC. (US) 2006-12-21 WO disclosed