SCHEMBL4427337

SCHEMBL4427337

FC(F)(F)c1cc(COc2[c]cccc2)cc(C(F)(F)F)c1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.46
TACR1 P25103 16/20 0.44
CACNA1F O60840 1/20 0.44
CACNA1D Q01668 1/20 0.44
CACNA1S Q13698 1/20 0.44
CACNA1C Q13936 1/20 0.44
MAOB P27338 2/20 0.39
SLC6A4 P31645 1/20 0.39

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
SCHEMBL3321623 0.88 IDO1 (0.54) IDO1MAOB
SCHEMBL9033990 0.85 GPR84 (0.45) IDO1TACR1CACNA1FCACNA1DCACNA1S
SCHEMBL5146701 0.80 IDO1 (0.45) IDO1TACR1CACNA1FCACNA1DCACNA1S
SCHEMBL5672700 0.79 IDO1 (0.41) IDO1MAOB
SCHEMBL9034118 0.77 GPR84 (0.39) TACR1CACNA1FCACNA1DCACNA1SCACNA1C
SCHEMBL9036408 0.77 IDO1 (0.45) IDO1TACR1CACNA1FCACNA1DCACNA1S
SCHEMBL9038883 0.77 TAAR1 (0.49) IDO1MAOB
SCHEMBL697657 0.77 FFAR1 (0.40) IDO1MAOBSLC6A4
SCHEMBL95381 0.76 TSHR (0.44) IDO1MAOB
SCHEMBL10830875 0.76 TACR1 (0.41) TACR1CACNA1FCACNA1DCACNA1SCACNA1C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220218663-A1 METHOD FOR PREVENTING AND/OR TREATING CHRONIC TRAUMATIC ENCEPHALOPATHY-I EUSTRALIS PHARMACEUTICALS LIMITED (TRADING AS PRESSURA NEURO) (AU) 2022-07-14 US disclosed
US-20210100773-A1 METHOD FOR PREVENTING AND/OR TREATING CHRONIC TRAUMATIC ENCEPHALOPATHY-I EUSTRALIS PHARMACEUTICALS LIMITED (TRADING AS PRESSURA NEURO) (AU) 2021-04-08 US disclosed
US-10729677-B2 Method for preventing and/or treating chronic traumatic encephalopathy-I EUSTRALIS PHARMACEUTICAL LIMITED (TRADING AS PRESSURA NEURO) (AU) 2020-08-04 US disclosed
US-20160143881-A1 METHOD FOR PREVENTING AND/OR TREATING CHRONIC TRAUMATIC ENCEPHALOPATHY-I EUSTRALIS PHARMACETICALS LIMITED (TRADING AS PRESSURA NEURO) (AU) 2016-05-26 US disclosed
EP-2104494-A1 METHOD FOR REDUCING INFLAMMATORY RESPONSES AND INFLAMMATION Adelaide Research & Innovation Pty Ltd. (AU) 2009-09-30 EP disclosed
WO-2008067610-A1 METHOD FOR REDUCING INFLAMMATORY RESPONSES AND INFLAMMATION ADELAIDE RESEARCH & INNOVATION PTY LTD (AU) 2008-06-12 WO disclosed
US-5561130-A USED TO PREVENT OR TREAT PAIN, INFLAMMATION, MIGRANES AND/OR ARTHRITIS MERCK SHARP & DOHME LIMITED (GB) 1996-10-01 US disclosed
US-5512570-A Treatment of emesis with morpholine tachykinin receptor antagonists MERCK & CO., INC. (US) 1996-04-30 US disclosed