SCHEMBL7433733

SCHEMBL7433733

Cc1cccc(-c2c[nH]c(C(N)=O)n2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 1/20 0.48
XDH P47989 1/20 0.48
KMO O15229 2/20 0.47
ATP4A P20648 2/20 0.45
ATP4B P51164 2/20 0.45
PARP1 P09874 1/20 0.45
CDC7 O00311 1/20 0.44
ICMT O60725 1/20 0.44
PIN1 Q13526 1/20 0.43
TLR8 Q9NR97 2/20 0.43
IDO1 P14902 1/20 0.43
METAP2 P50579 1/20 0.43
MAP2K4 P45985 1/20 0.42
CSNK1D P48730 1/20 0.42
CSNK1E P49674 1/20 0.42
MAPK14 Q16539 1/20 0.42
RAB9A P51151 1/20 0.41
RIPK2 O43353 1/20 0.41
ATR Q13535 1/20 0.41
SLC9A1 P19634 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
SCHEMBL14564382 0.83 DHODH (0.50) DHODHKMOPARP1CDC7CSNK1D
SCHEMBL4243696 0.82 MAP2K3 (0.47) DHODHPARP1RAB9A
SCHEMBL7438138 0.82 HPGDS (0.54) KMOPARP1CDC7ICMTPIN1
SCHEMBL7489817 0.80 JAK2 (0.52) KMORAB9A
SCHEMBL7434507 0.80 ALPL (0.47) RAB9A
SCHEMBL7434800 0.77 SLC9A1 (0.41) DHODHXDHKMOATP4AATP4B
SCHEMBL31110323 0.77 MKNK1 (0.51) DHODHKMOPARP1METAP2
SCHEMBL10604269 0.75 IDO1 (0.51) XDHKMOATP4AATP4BIDO1
SCHEMBL7434796 0.74 SLC9A1 (0.41) XDHKMOATP4AATP4BPIN1
SCHEMBL14564398 0.73 SCN9A (0.64) KMOPARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0506194-B1 4-aryl-thiazole or imidazole derivatives AKZO NOBEL NV (NL) 1996-08-21 EP disclosed
US-5462959-A 4-aryl-imidazole derivatives AKZO N.V. (NL) 1995-10-31 US disclosed
US-5254575-A 4-aryl-thiazole derivatives AKZO N.V. (NL) 1993-10-19 US disclosed
EP-0506194-A1 4-aryl-thiazole or imidazole derivatives Akzo Nobel N.V. (NL) 1992-09-30 EP disclosed