SCHEMBL14252940

SCHEMBL14252940

Cc1ccnc(-c2ccc(C(=O)Nc3ccc(C)cc3C(=O)O)cc2)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.62
▸ KMT2A Q03164 2/20 0.62
▸ GFER P55789 1/20 0.62
▸ ALDH1A1 P00352 2/20 0.59
▸ MAPT P10636 1/20 0.59
▸ HTT P42858 1/20 0.59
▸ TDP1 Q9NUW8 1/20 0.59
▸ PLK1 P53350 10/20 0.55
▸ ATM Q13315 1/20 0.54
▸ PLK3 Q9H4B4 1/20 0.54
▸ CA12 O43570 1/20 0.53
▸ CA1 P00915 1/20 0.53
▸ CA4 P22748 1/20 0.53
▸ CA7 P43166 1/20 0.53
▸ KDM1A O60341 1/20 0.51
▸ HDAC1 Q13547 1/20 0.51
▸ HDAC6 Q9UBN7 1/20 0.51
▸ SERPINE1 P05121 1/20 0.49
▸ NPC1 O15118 1/20 0.49
▸ RAB9A P51151 1/20 0.49

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
SCHEMBL14082419 0.86 NPC1 (0.61) ALDH1A1MAPTATMKDM1AHDAC1
SCHEMBL29179747 0.83 MEN1 (0.82) MEN1KMT2AGFERALDH1A1MAPT
SCHEMBL14075221 0.82 MEN1 (0.72) MEN1KMT2AGFERALDH1A1MAPT
SCHEMBL11834604 0.81 MEN1 (0.85) MEN1KMT2AGFERALDH1A1MAPT
SCHEMBL14082325 0.80 NPC1 (0.60) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL14082429 0.80 RXFP1 (0.60) MEN1KMT2AALDH1A1MAPTSERPINE1
SCHEMBL14082359 0.79 NPC1 (0.71) MEN1KMT2AALDH1A1MAPTHTT
SCHEMBL14082392 0.79 KCNMA1 (0.56) MEN1KMT2AALDH1A1MAPTATM
SCHEMBL19433797 0.78 LOXL2 (0.60) ALDH1A1HTTKDM1AHDAC1HDAC6
SCHEMBL14082399 0.78 NPC1 (0.63) MEN1KMT2AALDH1A1MAPTATM

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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