SCHEMBL19850215

SCHEMBL19850215

N#Cc1cccc(-c2cccc3c4cccc(-c5cccc(C#N)n5)c4n(-c4cccc5c4C(=O)N(c4ccc(-c6ccccc6)cc4)C5O)c23)n1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 3/20 0.36
▸ ALDH1A1 P00352 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ PDE6D O43924 1/20 0.35
▸ NPC1 O15118 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ EIF4E P06730 1/20 0.31
▸ PDE10A Q9Y233 1/20 0.31
▸ USP30 Q70CQ3 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
SCHEMBL19843138 0.85 CTSS (0.34) RAB9AALDH1A1HSD17B10NPC1TP53
SCHEMBL19842389 0.83 P2RX3 (0.37) RAB9AALDH1A1HSD17B10PDE6DNPC1
SCHEMBL19843413 0.82 PDE6D (0.46) RAB9AALDH1A1PDE6DNPC1SMN1; SMN2
SCHEMBL23476533 0.80 CTSS (0.33) EIF4EUSP30
SCHEMBL19843051 0.80 CTSS (0.33) EIF4EUSP30
SCHEMBL24283300 0.80 RAB9A (0.38) RAB9AALDH1A1HSD17B10PDE6DNPC1
SCHEMBL19843580 0.79 PDE6D (0.36) RAB9AHSD17B10PDE6DNPC1TP53
SCHEMBL23476534 0.78 IRAK4 (0.33) MEN1KMT2AATMEIF4E
SCHEMBL19843233 0.78 RAB9A (0.32) RAB9AALDH1A1HSD17B10NPC1TP53
SCHEMBL19850250 0.78 EIF4E (0.32) EIF4E

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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