SCHEMBL29875713

SCHEMBL29875713

Nc1cc(C(F)(F)F)ccc1Oc1ccc2c3c(cccc13)C(=O)OC2=O

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 3/20 0.48
▸ MAPT P10636 2/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48
▸ RAB9A P51151 1/20 0.45
▸ LMNA P02545 1/20 0.42
▸ ATM Q13315 1/20 0.42
▸ TYMS P04818 5/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ PARP1 P09874 1/20 0.36
▸ HDAC1 Q13547 1/20 0.35
▸ HDAC6 Q9UBN7 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ PKM P14618 1/20 0.35

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
SCHEMBL29886848 0.88 KMT2A (0.43) L3MBTL1MAPTNPSR1RAB9ALMNA
SCHEMBL24634087 0.88 KMT2A (0.43) L3MBTL1MAPTNPSR1RAB9ALMNA
SCHEMBL17726870 0.84 MAPT (0.43) L3MBTL1MAPTNPSR1ATMTYMS
SCHEMBL29875769 0.82 KMT2A (0.39) L3MBTL1MAPTNPSR1LMNATYMS
SCHEMBL30678538 0.82 MASP2 (0.53) L3MBTL1MAPTNPSR1LMNATYMS
SCHEMBL24633993 0.82 TYMS (0.43) MAPTNPSR1LMNAATMTYMS
SCHEMBL16684611 0.81 TYMS (0.47) MAPTNPSR1LMNAATMTYMS
SCHEMBL30557400 0.81 TYMS (0.47) MAPTNPSR1LMNAATMTYMS
SCHEMBL14303997 0.80 KMT2A (0.49) L3MBTL1MAPTNPSR1RAB9ALMNA
SCHEMBL8935331 0.76 L3MBTL1 (0.69) L3MBTL1MAPTNPSR1RAB9ALMNA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117063288-A Boron-containing cyclic light-emitting compound and color conversion film comprising same 日东电工株式会社 2023-11-14 — — CN disclosed
WO-2022178450-A1 BORON-CONTAINING CYCLIC EMISSIVE COMPOUNDS AND COLOR CONVERSION FILM CONTAINING THE SAME NITTO DENKO CORPORATION (JP) 2022-08-25 — — WO disclosed
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