SCHEMBL8059416

SCHEMBL8059416

Cc1c(C)c2c(c(CCCc3ccc(O)cc3O)c1O)CCC(C)(C)O2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TYR P14679 5/20 0.41
▸ MAPT P10636 3/20 0.39
▸ CYP3A4 P08684 2/20 0.39
▸ TSHR P16473 2/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ TP53 P04637 1/20 0.39
▸ ALOX5 P09917 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ PDE4D Q08499 1/20 0.36
▸ TTPA P49638 2/20 0.35
▸ PTGS1 P23219 1/20 0.35
▸ PTGS2 P35354 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ MALT1 Q9UDY8 1/20 0.35
▸ CYP19A1 P11511 1/20 0.35
▸ LMNA P02545 2/20 0.34
▸ GSTP1 P09211 1/20 0.34

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
SCHEMBL7792567 0.84 PTGS1 (0.38) CYP3A4TSHRKMT2AALOX5PDE4D
SCHEMBL7786640 0.82 PTGS1 (0.39) MAPTCYP3A4TSHRMEN1KMT2A
SCHEMBL7792572 0.81 CTSB (0.45) —
SCHEMBL8060477 0.81 TYR (0.41) TYRMAPTCYP3A4TSHRMEN1
SCHEMBL14283899 0.80 CYP3A4 (0.47) MAPTCYP3A4TSHRMEN1KMT2A
SCHEMBL1285801 0.77 PTGS1 (0.40) MAPTCYP3A4TSHRMEN1KMT2A
SCHEMBL5772521 0.77 CYP3A4 (0.43) MAPTCYP3A4TSHRMEN1KMT2A
SCHEMBL14283909 0.75 CYP3A4 (0.47) MAPTCYP3A4TSHRMEN1KMT2A
SCHEMBL5769978 0.74 CYP3A4 (0.46) MAPTCYP3A4TSHRMEN1KMT2A
SCHEMBL5774081 0.73 TTPA (0.49) MAPTCYP3A4TSHRMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6093836-A INHIBITORY ACTIVITY AGAINT MELANIN BIOSYNTHESIS; WHITENING SUBSTANCES FOR MEDICAMENTS, COSMETICS LG CHEMICAL LTD. (KR) 2000-07-25 — — US disclosed
EP-0909267-A1 NOVEL 1,3-DIPHENYLPROPANE DERIVATIVES HAVING INHIBITORY ACTIVITY AGAINST TYROSINASE AND PROCESS FOR PREPARATION THEREOF LG CHEMICAL LIMITED (KR) 1999-04-21 — — EP disclosed
WO-1998039279-A1 NOVEL 1,3-DIPHENYLPROPANE DERIVATIVES HAVING INHIBITORY ACTIVITY AGAINST TYROSINASE AND PROCESS FOR PREPARATION THEREOF LG CHEMICAL LTD. (KR) 1998-09-11 — — WO disclosed
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