SCHEMBL6663901

SCHEMBL6663901

C=CC(=O)Nc1cccc(O)c1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 6/20 0.48
PTPN1 P18031 1/20 0.44
PTPN11 Q06124 1/20 0.44
MMP2 P08253 5/20 0.44
MMP9 P14780 5/20 0.44
MMP1 P03956 4/20 0.44
GSTO1 P78417 2/20 0.42
LMNA P02545 2/20 0.42
F13A1 P00488 1/20 0.42
TGM1 P22735 1/20 0.42
TGM3 Q08188 1/20 0.42
BTK Q06187 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MAPT P10636 1/20 0.40
PKM P14618 1/20 0.40
ADAMTS4 O75173 1/20 0.39
ALDH1A1 P00352 1/20 0.39
EGFR P00533 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39

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
SCHEMBL413017 0.85 MMP1 (0.59) TGM2PTPN1PTPN11MMP2MMP9
SCHEMBL29366956 0.85 MMP1 (0.59) TGM2PTPN1PTPN11MMP2MMP9
SCHEMBL8603981 0.83 TGM2 (0.46) TGM2PTPN1PTPN11GSTO1LMNA
SCHEMBL14666462 0.82 PTPN1 (0.53) TGM2PTPN1PTPN11LMNAF13A1
SCHEMBL7191119 0.82 BTK (0.49) TGM2PTPN1PTPN11MMP2MMP9
SCHEMBL2355728 0.81 KDM4E (0.55) TGM2PTPN1PTPN11MMP2LMNA
SCHEMBL613090 0.80 TGM2 (0.65) TGM2PTPN1PTPN11GSTO1LMNA
SCHEMBL31228347 0.80 TGM2 (0.65) TGM2PTPN1PTPN11GSTO1LMNA
SCHEMBL11331053 0.79 TGM2 (0.53) TGM2PTPN1PTPN11MMP2MMP9
SCHEMBL9399515 0.78 TGM2 (0.42) TGM2PTPN1PTPN11MMP2MMP9

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
CN-1688287-A Skin lightening agents comprising coumarins derived from resorcinol derivatives UNILEVER PLC (NL) 2005-10-26 CN disclosed
WO-2004017936-A1 SKIN LIGHTENING AGENTS COMPRISING COUMARIN DERIVED FROM RESORCINOL DERIVATIVES UNILEVER PLC (GB) 2004-03-04 WO disclosed