SCHEMBL14115709

SCHEMBL14115709

CCN(C(C)=O)c1ccc(C)c(N(O)O)c1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ CYP3A4 P08684 3/20 0.38
▸ LMNA P02545 2/20 0.38
▸ MEN1 O00255 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ TSHR P16473 2/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ GLA P06280 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ TSPO P30536 1/20 0.36
▸ NPC1 O15118 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ PGR P06401 1/20 0.34
▸ HPGD P15428 1/20 0.33

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
SCHEMBL9419196 0.79 MEN1 (0.55) SMN1; SMN2CYP3A4LMNAMEN1KMT2A
SCHEMBL9419174 0.79 SMN1; SMN2 (0.49) SMN1; SMN2CYP3A4LMNAMEN1KMT2A
SCHEMBL9135996 0.79 TDP1 (0.44) SMN1; SMN2CYP3A4LMNAMEN1KMT2A
SCHEMBL10048292 0.78 ALDH1A1 (0.49) SMN1; SMN2LMNAKMT2AALDH1A1NPC1
SCHEMBL10965817 0.77 MEN1 (0.42) SMN1; SMN2CYP3A4LMNAMEN1KMT2A
SCHEMBL11815620 0.75 ALDH1A1 (0.47) SMN1; SMN2CYP3A4MEN1KMT2ATSHR
SCHEMBL29940658 0.75 MAPT (0.47) SMN1; SMN2CYP3A4LMNAMEN1KMT2A
SCHEMBL21678069 0.73 BAZ2B (0.43) SMN1; SMN2CYP3A4LMNAMEN1KMT2A
SCHEMBL10282142 0.73 ALDH1A1 (0.48) SMN1; SMN2MEN1KMT2ATSHRALDH1A1
SCHEMBL997530 0.73 TSHR (0.49) SMN1; SMN2CYP3A4LMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1670770-B1 BENZIMIDAZOLE DERIVATIVES, COMPOSITIONS CONTAINING THEM, PREPARATION THEROF AND USES THEREOF ASTRAZENECA AB (SE) 2008-08-20 — — EP disclosed
EP-1670790-B1 BENZIMIDAZOLE DERIVATIVES, COMPOSITIONS CONTAINING THEM, PREPARATION THEREOF AND USES THEREOF ASTRAZENECA AB (SE) 2008-08-20 — — EP disclosed
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