SCHEMBL23747858

SCHEMBL23747858

FC(F)(F)c1ccc2ncc(Cc3ccccc3Cl)c(-c3ccccc3)c2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 2/20 0.41
CSNK1D P48730 1/20 0.41
ESR1 P03372 1/20 0.40
KCNJ5 P48544 1/20 0.39
KCNJ3 P48549 1/20 0.39
TACR1 P25103 2/20 0.39
FABP4 P15090 2/20 0.39
FABP5 Q01469 2/20 0.39
CCNC P24863 1/20 0.38
CDK8 P49336 1/20 0.38
DHFR P00374 2/20 0.38
DHODH Q02127 1/20 0.38
P2RX7 Q99572 1/20 0.37
NR1H3 Q13133 1/20 0.37
GRIN1 Q05586 1/20 0.36
GRIN2B Q13224 1/20 0.36
NPBWR1 P48145 1/20 0.36
SLC16A3 O15427 1/20 0.36
SLC16A1 P53985 1/20 0.36
MCTS1 Q9ULC4 1/20 0.36

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
SCHEMBL1124874 0.75 NR1H2 (0.55) NR1H2NR1H3
SCHEMBL9169732 0.75 ESR1 (0.47) ESR1TACR1FABP4FABP5CCNC
SCHEMBL9162858 0.70 ABCG2 (0.43) ESR1TACR1DHODH
SCHEMBL4712613 0.70 CSNK1D (0.44) NR1H2CSNK1DKCNJ5KCNJ3P2RX7
SCHEMBL28328975 0.69 GRM5 (0.46) ESR1
SCHEMBL29712652 0.69 GRM5 (0.46) ESR1
SCHEMBL11814128 0.67 GRIN2B (0.46) CSNK1DKCNJ5KCNJ3GRIN2B
SCHEMBL8784587 0.67 ALDH1A1 (0.49) ESR1FABP4FABP5
SCHEMBL439770 0.66 BACE1 (0.42) CSNK1DCCNCCDK8NPBWR1
SCHEMBL10436780 0.65 PIK3CA (0.57) CCNCCDK8DHODHNPBWR1

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-3368514-B1 TRISUBSTITUTED SILYLPHENOXYHETEROCYCLES AND ANALOGUES BAYER CROPSCIENCE AG (DE) 2021-08-18 EP claimed