SCHEMBL25460695

SCHEMBL25460695

Cc1cc(C)nc(-c2ccc(-c3cccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3)c(-c3cccc(-c4nc(-c5ccccc5)cc(-c5ccccc5)n4)c3)c2)n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 11/20 0.51
▸ KMT2A Q03164 11/20 0.51
▸ HPGD P15428 9/20 0.51
▸ MAPT P10636 8/20 0.51
▸ ALDH1A1 P00352 7/20 0.51
▸ KDM4E B2RXH2 5/20 0.49
▸ LMNA P02545 3/20 0.49
▸ GLA P06280 1/20 0.49
▸ NTSR1 P30989 1/20 0.47
▸ CYP2C19 P33261 2/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ RXFP1 Q9HBX9 1/20 0.43
▸ L3MBTL1 Q9Y468 3/20 0.42
▸ ABCG2 Q9UNQ0 2/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ ATM Q13315 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ ADORA2A P29274 1/20 0.41

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
SCHEMBL25460536 0.94 LMNA (0.51) MEN1KMT2AHPGDMAPTALDH1A1
SCHEMBL25461308 0.94 CYP1A1 (0.46) MEN1KMT2AHPGDMAPTALDH1A1
SCHEMBL25462122 0.94 MEN1 (0.46) MEN1KMT2AHPGDMAPTALDH1A1
SCHEMBL25461755 0.89 RAB9A (0.46) MEN1KMT2AHPGDMAPTLMNA
SCHEMBL25460956 0.89 LMNA (0.46) MEN1KMT2AHPGDMAPTALDH1A1
SCHEMBL25460524 0.88 LMNA (0.49) MEN1KMT2AHPGDMAPTALDH1A1
SCHEMBL25460945 0.87 LMNA (0.47) MEN1KMT2AHPGDMAPTALDH1A1
SCHEMBL22309529 0.85 MEN1 (0.58) MEN1KMT2AHPGDMAPTALDH1A1
SCHEMBL22309217 0.85 MEN1 (0.58) MEN1KMT2AHPGDMAPTALDH1A1
SCHEMBL17932791 0.84 LMNA (0.61) MEN1KMT2AHPGDMAPTALDH1A1

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-2023085637-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2023-05-19 — — WO disclosed
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