SCHEMBL19850200

SCHEMBL19850200

O=C1c2c(cccc2-n2c3ccccc3c3cccc(-c4cncnc4)c32)C(O)N1c1c(-c2ccccc2)cc(-c2ccccc2)cc1-c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ DUSP3 P51452 1/20 0.35
▸ HDAC8 Q9BY41 1/20 0.32
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ MAPK14 Q16539 2/20 0.31
▸ PADI4 Q9UM07 3/20 0.30
▸ CYP1B1 Q16678 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
SCHEMBL19850058 0.90 DUSP3 (0.38) DUSP3HDAC8MEN1KMT2AATM
SCHEMBL19842746 0.90 MEN1 (0.35) DUSP3MEN1KMT2AATMCYP1B1
SCHEMBL19842828 0.89 EDNRB (0.36) DUSP3MEN1KMT2AATMMAPK14
SCHEMBL23516303 0.88 RAB9A (0.37) DUSP3HDAC8MEN1KMT2AATM
SCHEMBL19842966 0.88 ALDH1A1 (0.33) DUSP3MEN1KMT2AATMMAPK14
SCHEMBL23516111 0.87 DUSP3 (0.33) DUSP3MEN1KMT2AATMMAPK14
SCHEMBL19850205 0.87 EDNRB (0.30) HDAC8ATM
SCHEMBL24283043 0.86 MEN1 (0.31) DUSP3MEN1KMT2AATMMAPK14
SCHEMBL19842825 0.85 RAB9A (0.33) MEN1KMT2AATMCYP1B1
SCHEMBL23516067 0.85 MEN1 (0.38) DUSP3MEN1KMT2AATMCYP1B1

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-3494112-B1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2022-04-20 — — EP disclosed
WO-2018024725-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2018-02-08 — — WO disclosed
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