SCHEMBL17278340

SCHEMBL17278340

O=C1C2CC=CC=C2c2c(cc(-c3ccccc3)c3ccccc23)N1c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 1/20 0.31
▸ MEN1 O00255 3/20 0.31
▸ KMT2A Q03164 3/20 0.31
▸ ALDH1A1 P00352 3/20 0.31
▸ GAA P10253 3/20 0.31
▸ CES2 O00748 1/20 0.31
▸ BCHE P06276 1/20 0.31
▸ CES1 P23141 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ MAPK1 P28482 3/20 0.30
▸ L3MBTL1 Q9Y468 2/20 0.30
▸ KDM4E B2RXH2 2/20 0.30
▸ GLA P06280 2/20 0.30
▸ MAPT P10636 2/20 0.30
▸ HPGD P15428 2/20 0.30
▸ POLB P06746 1/20 0.30
▸ GPR84 Q9NQS5 1/20 0.30
▸ BRD4 O60885 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL14933537 0.81 CYP19A1 (0.33) HSD17B10MEN1KMT2AALDH1A1GAA
SCHEMBL4763054 0.66 FPR1 (0.38) MEN1KMT2AALDH1A1GAAMAPK1
SCHEMBL5545795 0.59 CFTR (0.44) MEN1KMT2A
SCHEMBL21236807 0.59 MEN1 (0.33) MEN1KMT2AALDH1A1GAACES2
SCHEMBL18162235 0.57 GPR84 (0.37) HSD17B10MEN1KMT2AALDH1A1GAA
SCHEMBL18905735 0.57 BACE1 (0.39) HSD17B10ALDH1A1GAACES2BCHE
SCHEMBL21537157 0.56 MEN1 (0.51) MEN1KMT2AALDH1A1GAACES2
SCHEMBL9857022 0.56 — —
SCHEMBL23938724 0.56 ALDH1A1 (0.35) HSD17B10ALDH1A1MAPK1HPGDPOLB
SCHEMBL183267 0.56 TTK (0.41) MEN1KMT2ACES2BCHECES1

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-2773721-B1 ORGANIC ELECTROLUMINESCENT DEVICE MERCK PATENT GMBH (DE) 2015-11-25 — — EP disclosed
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