SCHEMBL9305075

SCHEMBL9305075

[CH2]CCCc1ccccc1C(=O)OCC

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.61
ALDH1A1 P00352 4/20 0.53
HSD17B10 Q99714 3/20 0.53
SCN1A P35498 2/20 0.47
SCN2A Q99250 2/20 0.47
SCN3A Q9NY46 2/20 0.47
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
CDC25B P30305 2/20 0.46
CYP4F2 P78329 1/20 0.46
CYP4A11 Q02928 1/20 0.46
LMNA P02545 3/20 0.45
CYP3A4 P08684 2/20 0.45
TP53 P04637 1/20 0.45
MAPK1 P28482 1/20 0.45
KDM4E B2RXH2 2/20 0.43
CDC25A P30304 1/20 0.43
CDC25C P30307 1/20 0.43
MEN1 O00255 1/20 0.43
USP2 O75604 1/20 0.43

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
SCHEMBL5540432 0.90 TSHR (0.65) TSHRALDH1A1HSD17B10SCN1ASCN2A
SCHEMBL1791133 0.87 TSHR (0.65) TSHRALDH1A1HSD17B10SCN1ASCN2A
SCHEMBL20730321 0.86 TSHR (0.62) TSHRALDH1A1HSD17B10SCN1ASCN2A
SCHEMBL7782804 0.86 TSHR (0.62) TSHRALDH1A1HSD17B10SCN1ASCN2A
SCHEMBL3949422 0.84 TSHR (0.61) TSHRALDH1A1HSD17B10SCN1ASCN2A
SCHEMBL2416144 0.84 TSHR (0.61) TSHRALDH1A1HSD17B10SCN1ASCN2A
SCHEMBL29089577 0.84 TSHR (0.61) TSHRALDH1A1HSD17B10SCN1ASCN2A
SCHEMBL11590516 0.84 TSHR (0.61) TSHRALDH1A1HSD17B10SCN1ASCN2A
SCHEMBL11637746 0.84 TSHR (0.61) TSHRALDH1A1HSD17B10SCN1ASCN2A
SCHEMBL28280204 0.84 TSHR (0.61) TSHRALDH1A1HSD17B10SCN1ASCN2A

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-5354729-A Controlling weeds at low dosage; nonphytotoxic SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-10-11 US disclosed
EP-0579469-A2 N-acyldihydroquinoline derivatives as herbicides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-01-19 EP disclosed