SCHEMBL9769857

SCHEMBL9769857

C1CC2CC2C1.CCc1ccc(O)c(C(=O)O)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KLKB1 P03952 1/20 0.53
CTSB P07858 1/20 0.53
MMP9 P14780 1/20 0.53
DNMT1 P26358 1/20 0.53
DNMT3B Q9UBC3 1/20 0.53
DNMT3L Q9UJW3 1/20 0.53
DNMT3A Q9Y6K1 1/20 0.53
HNF4A P41235 1/20 0.51
KAT8 Q9H7Z6 2/20 0.50
LCK P06239 2/20 0.49
MCL1 Q07820 2/20 0.47
ACMSD Q8TDX5 4/20 0.47
ALDH1A1 P00352 3/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
USP2 O75604 1/20 0.46
MAPT P10636 1/20 0.46
EGFR P00533 1/20 0.43
CSNK2A1 P68400 1/20 0.42
TRPA1 O75762 1/20 0.42

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
SCHEMBL418713 0.84 KLKB1 (0.71) KLKB1CTSBMMP9DNMT1DNMT3B
SCHEMBL9769904 0.81 CSNK2A1 (0.69) KLKB1CTSBMMP9DNMT1DNMT3B
SCHEMBL9769838 0.77 KLKB1 (0.56) KLKB1CTSBMMP9DNMT1DNMT3B
SCHEMBL9769907 0.76 KAT8 (0.63) KLKB1CTSBMMP9DNMT1DNMT3B
SCHEMBL5990124 0.75 SMN1; SMN2 (0.47) KLKB1CTSBMMP9DNMT1DNMT3B
SCHEMBL5989624 0.74 TRPA1 (0.48) KLKB1CTSBMMP9DNMT1DNMT3B
SCHEMBL5989722 0.74 SMN1; SMN2 (0.46) KLKB1CTSBMMP9DNMT1DNMT3B
Salicylic Acid SCHEMBL16147316 0.73 ALDH1A1 (0.64) HNF4AMCL1ACMSDALDH1A1MEN1
SCHEMBL11631746 0.73 TRPA1 (0.55) KLKB1CTSBMMP9DNMT1DNMT3B
SCHEMBL30010714 0.72 CAMKK2 (0.45) ACMSDALDH1A1MAPTALOX15CASP1

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
US-4999333-A For facsimile and thermal printing FUJI PHOTO FILM CO., LTD. (JP) 1991-03-12 US disclosed
US-3983292-A Pressure sensitive recording papers SANKO CHEMICAL COMPANY LTD. (JA) 1976-09-28 US disclosed