SCHEMBL12181069

SCHEMBL12181069

C/C=C\c1c(C)cccc1NC(=O)c1ccc(C(C)C)cc1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.51
▸ TP53 P04637 2/20 0.51
▸ TRPV1 Q8NER1 1/20 0.48
▸ POLB P06746 2/20 0.46
▸ HPGD P15428 1/20 0.46
▸ HTT P42858 1/20 0.45
▸ LMNA P02545 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ RAB9A P51151 7/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ NPC1 O15118 6/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.42

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
SCHEMBL12651849 0.81 HTT (0.61) MAPTTP53TRPV1POLBHPGD
SCHEMBL17660226 0.81 HPGD (0.70) MAPTTP53TRPV1POLBHPGD
SCHEMBL12069179 0.76 NPC1 (0.55) MAPTHTTLMNAKDM4ERAB9A
SCHEMBL12068682 0.75 RAB9A (0.68) MAPTLMNAKDM4ERAB9AL3MBTL1
SCHEMBL12067847 0.74 NPC1 (0.50) MAPTPOLBHPGDHTTLMNA
SCHEMBL15652533 0.74 MAPT (0.55) MAPTTP53TRPV1POLBHTT
SCHEMBL12067338 0.72 RAB9A (0.54) MAPTHPGDHTTLMNAKDM4E
SCHEMBL24119315 0.71 HDAC1 (0.71) MAPTTP53RAB9ANPC1
SCHEMBL28574207 0.71 POLB (0.68) MAPTTP53POLBHPGDRAB9A
SCHEMBL11416317 0.70 MAOA (0.56) MAPTTP53POLBLMNAKDM4E

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-2011146483-A1 DRUG DELIVERY DEVICES FOR DELIVERY OF OCULAR THERAPEUTIC AGENTS AERIE PHARMACEUTICALS, INC. (US) 2011-11-24 — — WO disclosed
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