SCHEMBL22320258

SCHEMBL22320258

CCOC(=O)c1ccccc1-c1cc[c]cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.61
ERN1 O75460 1/20 0.53
HSD17B10 Q99714 4/20 0.53
ALDH1A1 P00352 3/20 0.53
SCN1A P35498 3/20 0.52
SCN2A Q99250 3/20 0.52
SCN3A Q9NY46 3/20 0.52
LMNA P02545 1/20 0.51
MAPT P10636 2/20 0.49
MEN1 O00255 1/20 0.49
USP2 O75604 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2C9 P11712 1/20 0.49
ALOX15 P16050 1/20 0.49
CYP2C19 P33261 1/20 0.49
MAPK10 P53779 1/20 0.49
KMT2A Q03164 1/20 0.49
PTK2B Q14289 1/20 0.49
NCOA1 Q15788 1/20 0.49

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
SCHEMBL396552 0.87 TSHR (0.69) TSHRERN1HSD17B10ALDH1A1SCN1A
Bicarbonate SCHEMBL27449726 0.85 TSHR (0.67) TSHRERN1HSD17B10ALDH1A1SCN1A
SCHEMBL3230316 0.84 TSHR (0.65) TSHRERN1HSD17B10ALDH1A1SCN1A
SCHEMBL27686802 0.84 TSHR (0.65) TSHRERN1HSD17B10ALDH1A1SCN1A
SCHEMBL29500171 0.84 TSHR (0.65) TSHRERN1HSD17B10ALDH1A1SCN1A
SCHEMBL1510227 0.84 TSHR (0.56) TSHRERN1HSD17B10ALDH1A1SCN1A
SCHEMBL29617021 0.83 TSHR (0.80) TSHRERN1HSD17B10ALDH1A1SCN1A
SCHEMBL3683272 0.83 TSHR (0.80) TSHRERN1HSD17B10ALDH1A1SCN1A
SCHEMBL8606461 0.83 TSHR (0.62) TSHRERN1HSD17B10ALDH1A1SCN1A
SCHEMBL1665510 0.82 TSHR (0.61) TSHRERN1HSD17B10ALDH1A1SCN1A

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-20200255658-A1 RESIN COMPOSITION, PRODUCTION METHOD OF THE SAME AND MOLDED PRODUCT Konica Minolta, Inc. (JP) 2020-08-13 US disclosed