SCHEMBL25751197

SCHEMBL25751197

C1=CC(c2ccc(-c3ccc(N(c4ccc(-c5cc(-c6ccccc6)cc6ccccc56)cc4)c4ccc(-c5ccccc5)c(-c5ccccc5)c4)cc3)cc2)=CCC1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
MPI P34949 1/20 0.34
KMT2A Q03164 1/20 0.34
HSD17B1 P14061 1/20 0.30
HSD17B2 P37059 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
SCHEMBL29294426 0.94 MEN1 (0.38) KDM4EMEN1ALDH1A1MAPTHPGD
SCHEMBL25751174 0.90 CA12 (0.36)
SCHEMBL25751222 0.90 CA12 (0.36)
SCHEMBL25751218 0.90 CA12 (0.36)
SCHEMBL19797561 0.89
SCHEMBL19597745 0.89
SCHEMBL22809398 0.89
SCHEMBL22809392 0.88 CA12 (0.34)
SCHEMBL19006922 0.88 GPR84 (0.34) KDM4EMEN1KMT2A
SCHEMBL25751392 0.88 ESR1 (0.33) HSD17B1HSD17B2

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-4198104-A1 ORGANIC ELECTROLUMINESCENT ELEMENT Hodogaya Chemical Co., Ltd. (JP) 2023-06-21 EP disclosed