SCHEMBL8957207

SCHEMBL8957207

O=C(O)Cc1nc(-c2ccccc2)n(Cc2ccccc2)c1Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.49
LMNA P02545 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
RECQL P46063 1/20 0.49
RAB9A P51151 1/20 0.49
PDE6D O43924 2/20 0.49
ALDH2 P05091 1/20 0.49
ALDH3A1 P30838 1/20 0.49
BCL2 P10415 1/20 0.47
MCL1 Q07820 1/20 0.47
KDM4E B2RXH2 4/20 0.46
HPGD P15428 2/20 0.46
HSD17B10 Q99714 1/20 0.43
PTGDR2 Q9Y5Y4 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
MAPK1 P28482 1/20 0.42
TP53 P04637 1/20 0.42
GAA P10253 2/20 0.41
CYP1A2 P05177 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
SCHEMBL11254294 0.88 ALDH1A1 (0.46) ALDH1A1LMNASMN1; SMN2RECQLRAB9A
SCHEMBL6967064 0.86 ALDH1A1 (0.51) ALDH1A1LMNASMN1; SMN2RECQLRAB9A
Hydrochloric Acid SCHEMBL11095632 0.83 ALDH1A1 (0.51) ALDH1A1LMNASMN1; SMN2RECQLRAB9A
SCHEMBL8954292 0.80 ALDH1A1 (0.49) ALDH1A1LMNASMN1; SMN2RECQLRAB9A
SCHEMBL11099962 0.77 ALDH1A1 (0.49) ALDH1A1LMNASMN1; SMN2RECQLRAB9A
SCHEMBL11099710 0.77 ALDH1A1 (0.49) ALDH1A1LMNASMN1; SMN2RECQLRAB9A
SCHEMBL6971889 0.75 AGTR1 (0.57)
SCHEMBL11164690 0.75 AGTR1 (0.46) ALDH1A1LMNASMN1; SMN2RECQLRAB9A
SCHEMBL6227119 0.75 ALDH1A1 (0.43) ALDH1A1LMNASMN1; SMN2RECQLRAB9A
SCHEMBL11090546 0.74 ALDH1A1 (0.54) ALDH1A1LMNASMN1; SMN2RECQLRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0028833-B1 IMIDAZOLE DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1984-01-25 EP claimed
EP-0028833-A2 Imidazole derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1981-05-20 EP claimed
EP-0536262-A4 SUBSTITUTED HISTIDINES SMITHKLINE BEECHAM CORP (US) 1996-08-14 EP disclosed
EP-0541705-A4 SUBSTITUTED 1H-IMIDAZOL-5-YL)ALKANOIC ACIDS 1993-11-10 EP disclosed
EP-0541705-A1 SUBSTITUTED 1H-IMIDAZOL-5-YL]ALKANOIC ACIDS SMITHKLINE BEECHAM CORPORATION (US) 1993-05-19 EP disclosed
EP-0536262-A1 SUBSTITUTED HISTIDINES SMITHKLINE BEECHAM CORPORATION (US) 1993-04-14 EP disclosed
EP-0525129-A4 SUBSTITUTED BENZIMIDAZOLES 1993-03-24 EP disclosed
EP-0525129-A1 SUBSTITUTED BENZIMIDAZOLES SMITHKLINE BEECHAM CORPORATION (US) 1993-02-03 EP disclosed
EP-0028833-B1 IMIDAZOLE DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1984-01-25 EP disclosed
US-4340598-A Hypotensive imidazole derivatives TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1982-07-20 US disclosed