SCHEMBL24282912

SCHEMBL24282912

N#Cc1cc(C#N)cc(-c2ccc3c4ccccc4n(-c4cccc5c4C(=O)N(c4c(-c6ccccc6)cccc4-c4ccccc4)C5O)c3c2)c1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 1/20 0.32
▸ KCNA5 P22460 1/20 0.31
▸ MAPK14 Q16539 1/20 0.31
▸ MEN1 O00255 2/20 0.30
▸ KMT2A Q03164 2/20 0.30
▸ ATM Q13315 2/20 0.30
▸ PDCD1 Q15116 1/20 0.30
▸ CD274 Q9NZQ7 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
SCHEMBL19843430 0.92 KCNA5 (0.33) PGRKCNA5MEN1KMT2AATM
SCHEMBL23516475 0.91 PGR (0.32) PGRKCNA5MEN1KMT2AATM
SCHEMBL24282870 0.90 FFAR2 (0.35) PGRPDCD1CD274
SCHEMBL19843237 0.89 PGR (0.36) PGRMEN1KMT2AATM
SCHEMBL19842865 0.88 KCNA5 (0.33) PGRKCNA5MEN1KMT2AATM
SCHEMBL19842812 0.88 MEN1 (0.35) KCNA5MEN1KMT2AATMPDCD1
SCHEMBL19843212 0.87 MEN1 (0.37) MAPK14MEN1KMT2AATM
SCHEMBL19842977 0.87 PGR (0.36) PGRMEN1KMT2AATM
SCHEMBL23476464 0.86 ATM (0.34) KCNA5MEN1KMT2AATM
SCHEMBL19842666 0.86 SSTR2 (0.34) MEN1KMT2AATMPDCD1CD274

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-3494112-B1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2022-04-20 — — EP disclosed
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