SCHEMBL22965296

SCHEMBL22965296

NC(COC(F)F)c1cccc(OC(F)F)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN4A P35499 6/20 0.42
KMT2A Q03164 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
DRD1 P21728 1/20 0.38
TACR1 P25103 1/20 0.38
MEP1B Q16820 1/20 0.36
DAO P14920 1/20 0.35
RXRA P19793 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2B Q13224 1/20 0.35
ANPEP P15144 1/20 0.34
ENPEP Q07075 1/20 0.34
MEN1 O00255 2/20 0.34
MAPT P10636 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
LMNA P02545 1/20 0.34
RAB9A P51151 1/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP7 Q9BQF6 1/20 0.34

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
SCHEMBL22952765 1.00 SCN4A (0.42) SCN4AKMT2ASMN1; SMN2DRD1TACR1
Hydrochloric Acid SCHEMBL28711049 0.98 SCN4A (0.41) SCN4AKMT2ASMN1; SMN2DRD1TACR1
Hydrochloric Acid SCHEMBL28711046 0.98 SCN4A (0.41) SCN4AKMT2ASMN1; SMN2DRD1TACR1
SCHEMBL21272639 0.86 TACR1 (0.41) SCN4ATACR1
SCHEMBL29440424 0.86 TACR1 (0.41) SCN4ATACR1
SCHEMBL21272641 0.86 TACR1 (0.41) SCN4ATACR1
SCHEMBL22952800 0.86 KMT2A (0.39) SCN4AKMT2ASMN1; SMN2DRD1MEP1B
SCHEMBL22965315 0.83 SCN4A (0.39) SCN4AKMT2ASMN1; SMN2DRD1TACR1
SCHEMBL22952697 0.83 SCN4A (0.39) SCN4AKMT2ASMN1; SMN2DRD1TACR1
SCHEMBL22952702 0.82 KMT2A (0.40) SCN4AKMT2ASMN1; SMN2DRD1MEP1B

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
WO-2021023617-A1 ALCOHOL DERIVATIVES AS KV7 POTASSIUM CHANNEL OPENERS H. LUNDBECK A/S (DK) 2021-02-11 WO disclosed