SCHEMBL14253102

SCHEMBL14253102

COc1cc(C(=O)Nc2ccc(Cl)c(C(C)(C)C)c2)ccc1-c1ncccc1OC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.51
▸ LMNA P02545 4/20 0.51
▸ GAA P10253 2/20 0.51
▸ GRM4 Q14833 4/20 0.49
▸ HDAC6 Q9UBN7 1/20 0.49
▸ TRPV1 Q8NER1 3/20 0.48
▸ AURKB Q96GD4 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ POLB P06746 2/20 0.47
▸ NR1H4 Q96RI1 1/20 0.45
▸ KDM4E B2RXH2 2/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ HTT P42858 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ MITF O75030 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ KCNQ3 O43525 1/20 0.44
▸ KCNQ2 O43526 1/20 0.44

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
SCHEMBL14083304 0.91 MAPT (0.63) MAPTLMNAGAAGRM4HDAC6
SCHEMBL14083302 0.87 GRM4 (0.63) MAPTLMNAGRM4HDAC6AURKB
SCHEMBL14083382 0.87 MAPT (0.59) MAPTLMNAGAAGRM4HDAC6
SCHEMBL14083759 0.85 MAPT (0.63) MAPTLMNAGAAGRM4HDAC6
SCHEMBL14083071 0.85 MAPT (0.63) MAPTLMNAGAAGRM4TRPV1
SCHEMBL14083101 0.85 MAPT (0.57) MAPTLMNAGAAGRM4TRPV1
SCHEMBL14083305 0.85 TP53 (0.61) MAPTTRPV1SMN1; SMN2
SCHEMBL14083301 0.84 AURKB (0.57) MAPTLMNAGRM4TRPV1AURKB
SCHEMBL14083318 0.84 MAPT (0.59) MAPTLMNAGAATRPV1AURKB
SCHEMBL14083383 0.83 TRPV1 (0.62) MAPTTRPV1SMN1; SMN2

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
US-7338950-B2 Amide compounds as ion channel ligands and uses thereof RENOVIS, INC. (US) 2008-03-04 — — US disclosed
US-7338950-B2 Amide compounds as ion channel ligands and uses thereof RENOVIS, INC. (US) 2008-03-04 — — US disclosed
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