SCHEMBL1823768

SCHEMBL1823768

CS(=O)(=O)c1cc(C(F)(F)F)ccc1C(=O)CC(=O)C1CC1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CACNA1B Q00975 8/20 0.46
NR1I2 O75469 3/20 0.46
TYK2 P29597 2/20 0.43
CYP3A4 P08684 1/20 0.39
CCR2 P41597 1/20 0.39
KDM4E B2RXH2 2/20 0.38
LIPC P11150 1/20 0.38
LIPG Q9Y5X9 1/20 0.38
ADRA1A P35348 1/20 0.38
KMT2A Q03164 1/20 0.38
GRM5 P41594 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CFTR P13569 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
SCHEMBL8815743 0.83 LIPC (0.42) CCR2KDM4ELIPCLIPGKMT2A
SCHEMBL8493700 0.82 RAB9A (0.38) KDM4EKMT2AALDH1A1
SCHEMBL7554628 0.81 TYK2 (0.45) CACNA1BNR1I2TYK2KDM4ELIPC
SCHEMBL8492085 0.81 F10 (0.41) TYK2KDM4EADRA1AALDH1A1
SCHEMBL8524590 0.80 MEN1 (0.46) KDM4ELIPCLIPGKMT2AALDH1A1
SCHEMBL8489374 0.80 CES2 (0.55) KDM4ELIPCLIPGKMT2AALDH1A1
SCHEMBL8755009 0.80 GRM5 (0.39) CACNA1BNR1I2TYK2KDM4ELIPC
SCHEMBL8489200 0.79 KDM4E (0.44) CYP3A4KDM4ELIPCLIPGKMT2A
SCHEMBL29391001 0.79 SLC6A9 (0.41) CCR2KDM4ELIPCLIPGKMT2A
SCHEMBL6751338 0.79 SLC6A9 (0.41) CCR2KDM4ELIPCLIPGKMT2A

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114456095-B Process for the preparation of isoxazole compounds and intermediates therefor 北京颖泰嘉和生物科技股份有限公司 2024-05-28 CN disclosed
EP-2504454-A1 ELITE EVENT EE-GM3 AND METHODS AND KITS FOR IDENTIFYING SUCH EVENT IN BIOLOGICAL SAMPLES Bayer CropScience NV (BE) 2012-10-03 EP disclosed
WO-2011063411-A1 ELITE EVENT EE-GM3 AND METHODS AND KITS FOR IDENTIFYING SUCH EVENT IN BIOLOGICAL SAMPLES BAYER BIOSCIENCE N.V. (BE) 2011-05-26 WO disclosed
EP-1066270-B1 ISOXAZOLE DERIVATIVES AND THEIR USE AS HERBICIDES SYNGENTA PARTICIPATIONS AG (CH) 2003-07-30 EP disclosed
US-6255251-B1 CONTROLLING WEEDS SYNGENTA CROP PROTECTION, INC. 2001-07-03 US disclosed
EP-1066270-A1 ISOXAZOLE DERIVATIVES AND THEIR USE AS HERBICIDES Novartis AG (CH) 2001-01-10 EP disclosed
WO-1999051583-A1 ISOXAZOLE DERIVATIVES AND THEIR USE AS HERBICIDES NOVARTIS AG (CH) 1999-10-14 WO disclosed