SCHEMBL9069775

SCHEMBL9069775

C=C(CCCCSCC)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.55
THRB P10828 2/20 0.38
HSD17B10 Q99714 2/20 0.38
GMNN O75496 1/20 0.38
TP53 P04637 1/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
CYP2C9 P11712 1/20 0.38
BLM P54132 1/20 0.38
TBXAS1 P24557 2/20 0.36
CES2 O00748 1/20 0.34
TET2 Q6N021 4/20 0.33
BHMT Q93088 2/20 0.33
TET3 O43151 1/20 0.33
TET1 Q8NFU7 1/20 0.33
FNTA P49354 1/20 0.33
FNTB P49356 1/20 0.33
PGGT1B P53609 1/20 0.33
AKR1B1 P15121 1/20 0.32
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL2523047 0.94 TSHR (0.63) TSHRTHRBHSD17B10GMNNTP53
SCHEMBL4276502 0.85 TSHR (0.50) TSHRHSD17B10TET2TET3TET1
SCHEMBL7649870 0.81 THRB (0.53) TSHRTHRBHSD17B10GMNNTP53
SCHEMBL722984 0.79 TSHR (0.59) TSHRTHRBHSD17B10GMNNTP53
SCHEMBL21117888 0.79 TSHR (0.43) TSHRCES2
SCHEMBL8218546 0.79 TSHR (0.86) TSHRHSD17B10BHMTAKR1B1PPARG
SCHEMBL2025802 0.78 TBXAS1 (0.47) TSHRTHRBHSD17B10TBXAS1TET2
SCHEMBL8769768 0.77 THRB (0.53) TSHRTHRBHSD17B10GMNNTP53
SCHEMBL17255856 0.77 TSHR (0.83) TSHRTHRBHSD17B10GMNNTP53
SCHEMBL848967 0.77 TSHR (0.83) TSHRTHRBHSD17B10GMNNTP53

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-5587279-A HIGH CONCENTRATION OF SILVER CHLORIDE GRAINS FUJI PHOTO FILM CO., LTD. (JP) 1996-12-24 US disclosed