SCHEMBL9848246

SCHEMBL9848246

CCCCCCCCCCC(CCC(N)=O)Oc1ccccc1S(=O)(=O)c1ccc(O)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTRC Q99895 1/20 0.42
PPARG P37231 3/20 0.36
MEN1 O00255 1/20 0.36
NR1I2 O75469 1/20 0.36
LMNA P02545 1/20 0.36
CHRM2 P08172 1/20 0.36
CYP3A4 P08684 1/20 0.36
ADRA2A P08913 1/20 0.36
MAPT P10636 1/20 0.36
OPRK1 P41145 1/20 0.36
HTR2B P41595 1/20 0.36
SLC6A3 Q01959 1/20 0.36
KMT2A Q03164 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
HTR6 P50406 1/20 0.34
HSD17B3 P37058 5/20 0.34
ESR1 P03372 2/20 0.34
PTGS2 P35354 1/20 0.34
ABCC9 O60706 1/20 0.34
ABCC8 Q09428 1/20 0.34

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
SCHEMBL10686180 0.80 CTRC (0.48) CTRCPPARGHTR6HSD17B3ESR1
SCHEMBL4637456 0.71 HTR6 (0.50) HTR6ESR1ABCC9ABCC8KCNJ11
SCHEMBL8615508 0.70 CTRC (0.62) CTRCLMNAKMT2AHSD17B3PPARA
SCHEMBL2445425 0.70 CTRC (0.62) CTRCLMNAKMT2AHSD17B3PPARA
SCHEMBL8617948 0.70 CTRC (0.62) CTRCLMNAKMT2AHSD17B3PPARA
SCHEMBL9293136 0.69 CTRC (0.59) CTRCLMNAKMT2AABCC9ABCC8
SCHEMBL9738555 0.69 HTR6 (0.47) MEN1KMT2AHTR6ESR1ABCC9
SCHEMBL1793070 0.68 HTR6 (0.46) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL1794497 0.68 HTR6 (0.46) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL7483301 0.68 NAMPT (0.50) MEN1LMNAMAPTKMT2AHTR6

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
EP-0421453-A1 Silver halide color photographic material FUJI PHOTO FILM CO., LTD. (JP) 1991-04-10 EP disclosed