SCHEMBL24523734

SCHEMBL24523734

N#Cc1ccc2c3cc(-c4c(-c5ccccc5)cccc4-c4ccccc4)cc4c5ccc(C#N)cc5n(c2c1)c34

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.38
CYP19A1 P11511 1/20 0.38
METAP2 P50579 1/20 0.36
FASN P49327 1/20 0.36
DPP4 P27487 2/20 0.35
ADORA2A P29274 1/20 0.35
ADRA2C P18825 1/20 0.35
ENPP3 O14638 1/20 0.34

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
SCHEMBL24523765 0.91 PTGDR2 (0.40) MEN1KMT2APTGDR2CYP19A1METAP2
SCHEMBL24523822 0.87 CA1 (0.41) MEN1KMT2APTGDR2CYP19A1METAP2
SCHEMBL24523719 0.86 MEN1 (0.39) MEN1KMT2APTGDR2CYP19A1FASN
SCHEMBL24523722 0.85 MEN1 (0.38) MEN1KMT2APTGDR2CYP19A1FASN
SCHEMBL24523804 0.85 GABRA1 (0.39) MEN1KMT2ACYP19A1FASNENPP3
SCHEMBL24523724 0.85 GABRA1 (0.39) MEN1KMT2ACYP19A1FASNENPP3
SCHEMBL24523830 0.82 ENPP3 (0.37) PTGDR2CYP19A1ADORA2AADRA2CENPP3
SCHEMBL24523808 0.82 CA1 (0.42) ENPP3
SCHEMBL24523831 0.81 ENPP3 (0.37) MEN1KMT2AENPP3
SCHEMBL24523743 0.81 RXFP1 (0.37) DPP4ENPP3

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
WO-2022129116-A1 INDOLO[3.2.1-JK]CARBAZOLE-6-CARBONITRILE DERIVATIVES AS BLUE FLUORESCENT EMITTERS FOR USE IN OLEDS MERCK PATENT GMBH (DE) 2022-06-23 WO disclosed