SCHEMBL12334252

SCHEMBL12334252

CC(O)(c1ccc(NC(=O)c2ccc(F)cc2F)cc1)C(F)(F)F

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SNCA P37840 3/20 0.56
▸ NPC1 O15118 4/20 0.52
▸ RAB9A P51151 4/20 0.52
▸ MAPT P10636 1/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ GPR27 Q9NS67 2/20 0.50
▸ AVPR2 P30518 1/20 0.50
▸ ALDH1A1 P00352 3/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49
▸ LMNA P02545 2/20 0.48
▸ GAA P10253 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ HDAC1 Q13547 1/20 0.46
▸ HSD11B1 P28845 1/20 0.46

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
SCHEMBL12334628 0.90 GPR27 (0.58) NPC1RAB9AGPR27ALDH1A1LMNA
SCHEMBL12334253 0.88 MEN1 (0.47) KMT2AHSD11B1
SCHEMBL12334579 0.86 SNCA (0.59) SNCANPC1RAB9AMAPTL3MBTL1
SCHEMBL12334059 0.84 MEN1 (0.67) NPC1RAB9AMAPTALDH1A1KDM4E
SCHEMBL7079567 0.77 SNCA (0.58) SNCANPC1RAB9AMAPTL3MBTL1
SCHEMBL12334244 0.77 TRPV1 (0.50) NPC1RAB9ALMNASMN1; SMN2
SCHEMBL12334246 0.77 RAB9A (0.61) NPC1RAB9AMAPTLMNAGAA
SCHEMBL6544730 0.76 SNCA (0.62) SNCANPC1RAB9AMAPTL3MBTL1
SCHEMBL27964618 0.76 SNCA (0.67) SNCANPC1RAB9AMAPTL3MBTL1
SCHEMBL677811 0.76 SNCA (0.67) SNCANPC1RAB9AMAPTL3MBTL1

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-2011115892-A1 MODULATORS OF THE RETINOIC ACID RECEPTOR-RELATED ORPHAN RECEPTORS GRIFFIN PATRICK R (US) 2011-09-22 — — WO disclosed
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