SCHEMBL9770220

SCHEMBL9770220

CCCCCCCCCCCCCCCCCCOc1ccc(C(C)(C)CC(C)(C)C)cc1S([NH])(=O)=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.41
THRA P10827 2/20 0.41
THRB P10828 2/20 0.41
S1PR3 Q99500 1/20 0.41
ALDH1A1 P00352 2/20 0.39
HPGD P15428 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.37
MEN1 O00255 2/20 0.37
MAPT P10636 2/20 0.37
RAD52 P43351 2/20 0.37
KMT2A Q03164 2/20 0.37
MAPK1 P28482 1/20 0.37
STAT3 P40763 1/20 0.37
HTT P42858 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
RCE1 Q9Y256 1/20 0.37
LMNA P02545 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL5665416 1.00 ESR1 (0.41) ESR1THRATHRBS1PR3ALDH1A1
SCHEMBL6550726 0.95 SMN1; SMN2 (0.41) ESR1THRATHRBS1PR3ALDH1A1
SCHEMBL9080738 0.90 ESR1 (0.38) ESR1THRATHRBS1PR3ALDH1A1
SCHEMBL5665417 0.90 CNR2 (0.46) ESR1THRATHRBS1PR3
SCHEMBL9770222 0.90 CNR2 (0.46) ESR1THRATHRBS1PR3
SCHEMBL9848228 0.89 FLT3 (0.46) ALDH1A1SMN1; SMN2MEN1MAPTKMT2A
SCHEMBL7526658 0.88 ESR1 (0.41) ESR1THRATHRBS1PR3ALDH1A1
SCHEMBL6536665 0.87 ESR1 (0.43) ESR1THRATHRBS1PR3ALDH1A1
SCHEMBL9770224 0.87 ESR1 (0.43) ESR1THRATHRBS1PR3ALDH1A1
SCHEMBL7651309 0.87 ESR1 (0.41) ESR1THRATHRBS1PR3ALDH1A1

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-5055386-A Excellent image storing properties FUJI PHOTO FILM CO., LTD. (JP) 1991-10-08 US disclosed