SCHEMBL19843233

SCHEMBL19843233

N#Cc1cc(C#N)cc(-c2cccc3c4cccc(-c5cc(C#N)cc(C#N)c5)c4n(-c4cccc5c4C(=O)N(c4cc(-c6ccccc6)cc(-c6ccccc6)c4)C5O)c23)c1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 3/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ ATM Q13315 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ NPC1 O15118 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ KCNA5 P22460 1/20 0.31
▸ CCKBR P32239 1/20 0.31
▸ SMO Q99835 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
SCHEMBL19842858 0.86 MEN1 (0.38) RAB9AMEN1KMT2AATMALDH1A1
SCHEMBL19850182 0.86 BACE1 (0.35) RAB9AMEN1KMT2AATMALDH1A1
SCHEMBL23476469 0.85 PGR (0.36) —
SCHEMBL19842825 0.84 RAB9A (0.33) RAB9AMEN1KMT2AATMALDH1A1
SCHEMBL19842753 0.84 RAB9A (0.39) RAB9AMEN1KMT2AATMALDH1A1
SCHEMBL19843237 0.84 PGR (0.36) MEN1KMT2AATM
SCHEMBL19842426 0.84 PDE10A (0.37) RAB9AMEN1KMT2AATMALDH1A1
SCHEMBL19842984 0.82 MEN1 (0.39) RAB9AMEN1KMT2AATMALDH1A1
SCHEMBL23516047 0.82 RAB9A (0.34) RAB9AMEN1KMT2AATMALDH1A1
SCHEMBL19850160 0.81 PDE6D (0.37) MEN1KMT2AALDH1A1TP53SMN1; SMN2

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-3279194-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2018-02-07 — — EP disclosed
Send feedback