SCHEMBL23420910

SCHEMBL23420910

CC(C)(C)c1cc(Br)c(O)cc1Cl.COc1cc(Cl)c(C(C)(C)C)cc1Br

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 2/20 0.45
▸ LMNA P02545 1/20 0.45
▸ TP53 P04637 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ CA1 P00915 1/20 0.36
▸ CA2 P00918 1/20 0.36
▸ ALDH1A1 P00352 4/20 0.35
▸ GAA P10253 1/20 0.35
▸ ALOX5 P09917 1/20 0.35
▸ PTGS2 P35354 1/20 0.35
▸ LCK P06239 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ ATP2A2 P16615 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ ATP2A3 Q93084 1/20 0.34
▸ FABP4 P15090 1/20 0.33
▸ WDR5 P61964 2/20 0.33

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
SCHEMBL23422047 0.87 ALOX15 (0.44) ALOX15LMNATP53CYP3A4HPGD
SCHEMBL13851451 0.75 CYP3A4 (0.50) ALOX15LMNATP53CYP3A4HPGD
SCHEMBL3692285 0.74 PRKDC (0.40) ALDH1A1GAALCKKDM4ETSHR
SCHEMBL3692943 0.74 PTPN1 (0.35) LCKTSHR
SCHEMBL13169383 0.74 LMNA (0.53) ALOX15LMNATP53CYP3A4HPGD
SCHEMBL7788363 0.73 ALOX5 (0.48) ALDH1A1ALOX5PTGS2POLB
SCHEMBL15628229 0.73 ALOX5 (0.48) ALDH1A1ALOX5PTGS2LCKPOLB
SCHEMBL3688018 0.73 GRIN2D (0.37) ALDH1A1MAPTTSHR
SCHEMBL20253183 0.73 ALOX15 (0.69) ALOX15LMNATP53CYP3A4HPGD
SCHEMBL21614378 0.72 DPP4 (0.46) HPGDALDH1A1ALOX5PTGS2LCK

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-2021106230-A1 NOVEL PHENOL COMPOUND OR SALT THEREOF 大鵬薬品工業株式会社 2021-06-03 — — WO disclosed
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