SCHEMBL21610798

SCHEMBL21610798

CC(C)c1cc(OC2CCC2)cc(C(F)(F)F)c1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SLC6A4 P31645 4/20 0.39
▸ SLC6A2 P23975 2/20 0.39
▸ SLC6A3 Q01959 1/20 0.37
▸ FFAR1 O14842 3/20 0.35
▸ PTGS1 P23219 1/20 0.35
▸ PTGS2 P35354 1/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ HTR2C P28335 2/20 0.34
▸ HTR2B P41595 2/20 0.34
▸ HTR6 P50406 1/20 0.34
▸ PDK2 Q15119 1/20 0.34
▸ GPR35 Q9HC97 1/20 0.34
▸ TACR1 P25103 2/20 0.33
▸ HTR2A P28223 1/20 0.33
▸ LIPG Q9Y5X9 1/20 0.33
▸ APP P05067 1/20 0.33

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
SCHEMBL10199729 0.95 SLC6A4 (0.38) SLC6A4SLC6A2SLC6A3FFAR1PTGS1
SCHEMBL21610857 0.94 SLC6A4 (0.40) SLC6A4SLC6A2SLC6A3FFAR1MEN1
SCHEMBL15713189 0.76 ACACB (0.36) SLC6A4SLC6A2SLC6A3FFAR1PTGS1
SCHEMBL15898899 0.75 MEN1 (0.38) SLC6A4SLC6A2FFAR1MEN1KMT2A
SCHEMBL10084735 0.75 RXRA (0.40) PTGS1MEN1KMT2ATACR1
SCHEMBL21610851 0.75 FFAR1 (0.41) FFAR1APP
SCHEMBL15611338 0.74 SLC6A2 (0.43) SLC6A4SLC6A2SLC6A3MEN1KMT2A
SCHEMBL13144931 0.74 ALDH1A1 (0.39) SLC6A4SLC6A2SLC6A3TACR1
SCHEMBL25556561 0.73 TACR1 (0.35) TACR1
SCHEMBL28376348 0.73 GPR35 (0.41) SLC6A4SLC6A2SLC6A3MEN1KMT2A

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
EP-3814332-B1 PESTICIDALLY ACTIVE AZOLE-AMIDE COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2023-06-07 — — EP disclosed
WO-2020002563-A1 PESTICIDALLY ACTIVE AZOLE-AMIDE COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2020-01-02 — — WO disclosed
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