SCHEMBL7795939

SCHEMBL7795939

COc1c(C)c(C)c(OCc2ccccc2)c(C)c1C(C)=O

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 2/20 0.56
PTPN1 P18031 1/20 0.50
KCNA2 P16389 1/20 0.48
KCNA5 P22460 1/20 0.48
KCNA1 Q09470 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
MAPT P10636 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
MAOB P27338 1/20 0.48
LMNA P02545 1/20 0.47
HPGD P15428 1/20 0.47
NPC1 O15118 1/20 0.46
MAPK1 P28482 1/20 0.46
RAB9A P51151 1/20 0.46

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
SCHEMBL7796134 0.94 KCNA3 (0.56) KCNA3PTPN1KCNA2KCNA5KCNA1
SCHEMBL7796139 0.92 PTPN1 (0.54) KCNA3PTPN1KCNA2KCNA5KCNA1
SCHEMBL7786636 0.87 PTPN1 (0.49) KCNA3PTPN1KCNA2KCNA5KCNA1
SCHEMBL31643912 0.85 KCNA3 (0.49) KCNA3PTPN1SMN1; SMN2MAPTCYP2C9
SCHEMBL31644176 0.82 LMNA (0.57) KCNA3PTPN1MAPTTDP1L3MBTL1
SCHEMBL13233013 0.80 PTPN1 (0.52) PTPN1SMN1; SMN2MAPTCYP2C9CYP2C19
SCHEMBL10998626 0.79 KCNA2 (0.61) KCNA3KCNA2KCNA5KCNA1
SCHEMBL8593396 0.79 PSMG3 (0.48) KCNA3PTPN1LMNAHPGD
SCHEMBL31643593 0.79 KCNA3 (0.45) KCNA3PTPN1SMN1; SMN2L3MBTL1LMNA
SCHEMBL24968079 0.79 L3MBTL1 (0.63) PTPN1SMN1; SMN2MAPTCYP2C9CYP2C19

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
EP-0909267-B1 NOVEL 1,3-DIPHENYLPROPANE DERIVATIVES HAVING INHIBITORY ACTIVITY AGAINST TYROSINASE AND PROCESS FOR PREPARATION THEREOF LG CHEMICAL LTD (KR) 2001-11-21 EP disclosed
US-6093836-A INHIBITORY ACTIVITY AGAINT MELANIN BIOSYNTHESIS; WHITENING SUBSTANCES FOR MEDICAMENTS, COSMETICS LG CHEMICAL LTD. (KR) 2000-07-25 US disclosed