SCHEMBL25550867

SCHEMBL25550867

CC1(C)C2=C(CCC=C2)c2ccc(-c3cccc(-c4cc(-c5ccccc5)nc(-c5ccccc5)c4)c3)cc21

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ RARA P10276 2/20 0.31
▸ RARB P10826 2/20 0.31
▸ PGR P06401 2/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ RARG P13631 2/20 0.30
▸ CYP19A1 P11511 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ HPGD P15428 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
SCHEMBL19527041 0.92 MEN1 (0.36) KMT2AMEN1RARARARBRARG
SCHEMBL22812708 0.89 MEN1 (0.33) KMT2AMEN1RARARARBPGR
SCHEMBL25550992 0.84 PDK2 (0.36) —
SCHEMBL17887061 0.84 PDK2 (0.36) —
SCHEMBL25525243 0.82 KMT2A (0.33) KMT2AMEN1CYP19A1KDM4EALDH1A1
SCHEMBL21140084 0.81 PDK2 (0.35) KMT2AMEN1ALDH1A1MAPTHPGD
SCHEMBL13221306 0.80 PDK2 (0.33) —
SCHEMBL14425879 0.79 MEN1 (0.43) KMT2AMEN1RAB9ACYP19A1KDM4E
SCHEMBL14425899 0.79 MEN1 (0.43) KMT2AMEN1RAB9ACYP19A1KDM4E
SCHEMBL25492716 0.78 ACACA (0.31) —

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-3239136-B1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME SOLUS ADVANCED MATERIALS CO LTD (KR) 2023-06-07 — — EP disclosed
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