SCHEMBL17745046

SCHEMBL17745046

CC(CCO)NC1=CC(=O)C(Nc2ccc(O)c(Cl)c2)=CC1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DNM1 Q05193 1/20 0.39
▸ GSK3B P49841 5/20 0.36
▸ RPS6KA3 P51812 1/20 0.36
▸ MAPT P10636 3/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ LMNA P02545 2/20 0.36
▸ STK10 O94804 3/20 0.36
▸ SLK Q9H2G2 3/20 0.36
▸ BCL6 P41182 2/20 0.35
▸ GSK3A P49840 2/20 0.34
▸ ADORA2A P29274 1/20 0.34
▸ ADORA1 P30542 1/20 0.34
▸ BRDT Q58F21 1/20 0.34
▸ MEN1 O00255 2/20 0.32
▸ MAPK1 P28482 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ GMNN O75496 1/20 0.32
▸ CCNB2 O95067 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CDK1 P06493 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
SCHEMBL17745047 0.79 ALDH1A1 (0.42) DNM1MAPTALDH1A1LMNABCL6
SCHEMBL15020452 0.77 DNM1 (0.42) DNM1GSK3BMAPTALDH1A1LMNA
SCHEMBL15020450 0.76 DNM1 (0.39) DNM1GSK3BMAPTALDH1A1LMNA
SCHEMBL11388748 0.74 DNM1 (0.47) DNM1GSK3BMAPTALDH1A1LMNA
SCHEMBL15039426 0.74 DNM1 (0.37) DNM1GSK3BMAPTALDH1A1LMNA
SCHEMBL11784246 0.70 DNM1 (0.42) DNM1GSK3BMAPTALDH1A1LMNA
SCHEMBL15039580 0.69 DNM1 (0.42) DNM1GSK3BMAPTALDH1A1LMNA
SCHEMBL15020065 0.69 DNM1 (0.42) DNM1GSK3BMAPTALDH1A1LMNA
SCHEMBL15020067 0.69 DNM1 (0.42) DNM1GSK3BMAPTALDH1A1LMNA
SCHEMBL17745049 0.68 — —

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
EP-2791106-B1 PARTICULAR QUINONE DIRECT DYES, DYE COMPOSITION COMPRISING AT LEAST ONE SUCH DYE, IMPLEMENTATION PROCESS THEREFOR AND USE THEROF OREAL (FR) 2016-05-18 — — EP disclosed
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