SCHEMBL8060477

SCHEMBL8060477

Cc1c(C)c2c(c(C(O)CCc3ccc(O)cc3O)c1O)CCC(C)(C)O2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TYR P14679 7/20 0.41
▸ PDE4D Q08499 1/20 0.35
▸ MALT1 Q9UDY8 1/20 0.35
▸ MAPT P10636 3/20 0.34
▸ LMNA P02545 2/20 0.34
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ GSTP1 P09211 1/20 0.34
▸ TTPA P49638 1/20 0.34
▸ USP2 O75604 1/20 0.34
▸ THRB P10828 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ NR1I2 O75469 1/20 0.33
▸ CA12 O43570 1/20 0.33
▸ CA1 P00915 1/20 0.33
▸ CA4 P22748 1/20 0.33
▸ CA5A P35218 1/20 0.33
▸ CA9 Q16790 1/20 0.33
▸ CA14 Q9ULX7 1/20 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
SCHEMBL7792676 0.82 TTPA (0.35) MAPTLMNAMEN1KMT2AGSTP1
SCHEMBL8059416 0.81 TYR (0.41) TYRPDE4DMALT1MAPTLMNA
SCHEMBL7792572 0.78 CTSB (0.45) —
SCHEMBL8385341 0.76 PDE4D (0.40) PDE4DMALT1MAPTLMNAMEN1
SCHEMBL8063175 0.76 TYR (0.58) TYRMAPTMEN1KMT2ACYP3A4
SCHEMBL7792567 0.74 PTGS1 (0.38) PDE4DMALT1KMT2ATTPANR1I2
SCHEMBL5768105 0.72 CYP3A4 (0.44) MAPTLMNAMEN1KMT2AGSTP1
SCHEMBL8059449 0.70 TYR (0.50) TYRMAPTMEN1KMT2ACYP3A4
SCHEMBL8063169 0.68 TYR (0.50) TYRMAPTMEN1KMT2ACYP3A4
SCHEMBL14283899 0.67 CYP3A4 (0.47) MAPTLMNAMEN1KMT2AGSTP1

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-6093836-A INHIBITORY ACTIVITY AGAINT MELANIN BIOSYNTHESIS; WHITENING SUBSTANCES FOR MEDICAMENTS, COSMETICS LG CHEMICAL LTD. (KR) 2000-07-25 — — US disclosed
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