SCHEMBL25945207

SCHEMBL25945207

C=Cc1ccc(COc2c(F)c(F)c(C(c3c(F)c(F)c(OCc4ccc(C=C)cc4)c(F)c3F)c3c(F)c(F)c(OCc4ccc(C=C)cc4)c(F)c3F)c(F)c2F)cc1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.34
▸ L3MBTL1 Q9Y468 3/20 0.34
▸ MAPT P10636 3/20 0.34
▸ POLB P06746 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ CYP1A2 P05177 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ LMNA P02545 2/20 0.32
▸ ALOX5AP P20292 1/20 0.31
▸ FEN1 P39748 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ MAOA P21397 1/20 0.31
▸ MAOB P27338 1/20 0.31
▸ TSHR P16473 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
SCHEMBL14867055 0.89 MAPT (0.41) ALDH1A1L3MBTL1MAPTPOLBTDP1
SCHEMBL13048615 0.83 ALDH1A1 (0.35) ALDH1A1L3MBTL1MAPTPOLBTDP1
SCHEMBL21141921 0.81 ALDH1A1 (0.34) ALDH1A1L3MBTL1MAPTPOLBTDP1
SCHEMBL23969913 0.81 ALDH1A1 (0.34) ALDH1A1L3MBTL1MAPTPOLBTDP1
SCHEMBL21141917 0.81 ALDH1A1 (0.46) ALDH1A1L3MBTL1MAPTPOLBTDP1
Lithium Ion SCHEMBL30085325 0.80 POLB (0.33) ALDH1A1L3MBTL1MAPTPOLBTDP1
SCHEMBL23664989 0.79 PPARG (0.33) ALDH1A1L3MBTL1MAPTPOLBTDP1
SCHEMBL2742186 0.77 TDP1 (0.42) ALDH1A1L3MBTL1MAPTPOLBTDP1
SCHEMBL8644283 0.73 ALDH1A1 (0.42) ALDH1A1L3MBTL1MAPTPOLBTDP1
SCHEMBL14655816 0.71 ALDH1A1 (0.41) ALDH1A1L3MBTL1MAPTPOLBCYP1A2

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
US-11702550-B2 Coating composition, organic light-emitting diode using same, and method for preparing same LG CHEM, LTD. 2023-07-18 — — US disclosed
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