SCHEMBL12483485

SCHEMBL12483485

CC(=O)Oc1cccc(C)c1-c1ccnnn1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 1/20 0.42
▸ ACHE P22303 2/20 0.39
▸ KDM4E B2RXH2 7/20 0.38
▸ ALDH1A1 P00352 4/20 0.38
▸ HPGD P15428 3/20 0.38
▸ MAPT P10636 3/20 0.38
▸ LMNA P02545 3/20 0.38
▸ TTR P02766 2/20 0.38
▸ MAPK1 P28482 2/20 0.38
▸ HTT P42858 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ ABCC4 O15439 1/20 0.38
▸ USP2 O75604 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ HSP90AA1 P07900 1/20 0.38
▸ CHRM2 P08172 1/20 0.38
▸ HSP90AB1 P08238 1/20 0.38
▸ HTR1A P08908 1/20 0.38
▸ ADRA2A P08913 1/20 0.38

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
SCHEMBL12484081 0.85 MEN1 (0.36) KDM4EALDH1A1MAPTKMT2AMEN1
SCHEMBL12483491 0.81 ACHE (0.46) PTPN1ACHEKDM4EALDH1A1HPGD
SCHEMBL4054446 0.80 INPPL1 (0.45) KDM4EALDH1A1HPGDMAPTUSP2
SCHEMBL14844977 0.79 PTPN1 (0.46) PTPN1ACHEKDM4EALDH1A1HPGD
SCHEMBL18202141 0.78 PTPN1 (0.48) PTPN1ACHEKDM4EALDH1A1HPGD
SCHEMBL28975051 0.78 MAPK1 (0.47) PTPN1ACHEKDM4EALDH1A1HPGD
SCHEMBL23743764 0.71 KMT2A (0.64) PTPN1ACHEKDM4EALDH1A1HPGD
SCHEMBL10607470 0.70 PTPN1 (0.54) PTPN1ACHEKDM4EALDH1A1HPGD
SCHEMBL14385380 0.68 KDM4E (0.47) PTPN1ACHEKDM4EALDH1A1HPGD
SCHEMBL742810 0.68 ACHE (0.62) PTPN1ACHEKDM4EALDH1A1HPGD

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
EP-2678341-A1 ALPHA HELIX MIMETICS AND METHODS RELATING THERETO PRISM Pharma Co., Ltd. (JP) 2014-01-01 — — EP claimed
WO-2012115286-A1 ALPHA HELIX MIMETICS AND METHODS RELATING THERETO PRISM BIOLAB CORPORATION (JP) 2012-08-30 — — WO claimed
Send feedback