SCHEMBL25089299

SCHEMBL25089299

CC1(C)c2ccccc2-c2cc(N(c3ccc(-c4ccc5c(c4)oc4ccccc45)cc3)c3ccc(-c4cccc5c4ccc4ccccc45)cc3)ccc21

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 1/20 0.33
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
KMT2A Q03164 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
MMP12 P39900 1/20 0.31
MMP13 P45452 1/20 0.31
DUSP3 P51452 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
SCHEMBL25089336 0.94 HCRTR1 (0.33) HCRTR1CA12CA1CA2CA9
SCHEMBL25088511 0.94 HCRTR1 (0.33) HCRTR1
SCHEMBL26059795 0.93 KDM4E (0.32) HCRTR1KDM4EMEN1ALDH1A1MAPT
SCHEMBL26060356 0.93 HCRTR1 (0.33) HCRTR1KDM4EMEN1ALDH1A1MAPT
SCHEMBL25089302 0.92 HCRTR1 (0.31) HCRTR1
SCHEMBL26059237 0.91 PGR (0.32) KDM4EMEN1ALDH1A1MAPTHPGD
SCHEMBL23376290 0.91 MEN1 (0.37) HCRTR1KDM4EMEN1ALDH1A1MAPT
SCHEMBL25089183 0.91 CYP1A1 (0.32) KDM4EALDH1A1MAPTHPGD
SCHEMBL26060357 0.90 KDM4E (0.32) HCRTR1KDM4EMEN1ALDH1A1MAPT
SCHEMBL26059797 0.90 HSP90AA1 (0.32) KDM4EMEN1ALDH1A1MAPTHPGD

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-2023027173-A1 COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT MATERIAL, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2023-03-02 WO disclosed