SCHEMBL7439221

SCHEMBL7439221

N=C(NO)c1nc(-c2ccccc2)c[nH]1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
RAB9A P51151 1/20 0.35
MAPK1 P28482 1/20 0.35
IDO1 P14902 1/20 0.34
METAP2 P50579 1/20 0.34
KEAP1 Q14145 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
CYP1A2 P05177 1/20 0.34
ALDH1A1 P00352 2/20 0.33
HPGD P15428 2/20 0.33
NOTUM Q6P988 1/20 0.33
PDGFRB P09619 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ADORA1 P30542 3/20 0.33
MAPT P10636 1/20 0.33
AGTR1 P30556 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
CDC7 O00311 1/20 0.32

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
SCHEMBL7426992 0.91 BPTF (0.36) MEN1KMT2ARAB9AMAPK1L3MBTL1
SCHEMBL7434796 0.78 SLC9A1 (0.41) RAB9AIDO1METAP2ALDH1A1KDM4E
SCHEMBL7440162 0.77 SLC9A1 (0.41) MEN1KMT2AIDO1KDM4EMAPT
SCHEMBL9324010 0.75 TP53 (0.44) MEN1KMT2ARAB9AMAPK1L3MBTL1
SCHEMBL27662263 0.75 TP53 (0.41) MEN1KMT2ARAB9AL3MBTL1CYP1A2
SCHEMBL7440585 0.73 ALPL (0.37) MEN1KMT2ARAB9AALDH1A1NOTUM
SCHEMBL4243696 0.72 MAP2K3 (0.47) MEN1KMT2ARAB9AALDH1A1KDM4E
SCHEMBL9521709 0.72 ALDH1A1 (0.41) MEN1KMT2ARAB9AALDH1A1HPGD
SCHEMBL21336547 0.72 MEN1 (0.38) MEN1KMT2ARAB9AALDH1A1HPGD
SCHEMBL259469 0.72 GAA (0.51) KMT2ACYP1A2ALDH1A1HPGDPDGFRB

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