SCHEMBL12483487

SCHEMBL12483487

CC(=O)Oc1cccc(-c2ncncn2)c1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 1/20 0.49
▸ POLB P06746 1/20 0.42
▸ TSHR P16473 3/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ PTPN1 P18031 2/20 0.41
▸ KDM4E B2RXH2 6/20 0.40
▸ LMNA P02545 4/20 0.40
▸ MAPK1 P28482 3/20 0.40
▸ TTR P02766 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ HPGD P15428 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ ABCC4 O15439 1/20 0.40
▸ USP2 O75604 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ HSP90AA1 P07900 1/20 0.40
▸ CHRM2 P08172 1/20 0.40
▸ HSP90AB1 P08238 1/20 0.40
▸ HTR1A P08908 1/20 0.40
▸ ADRA2A P08913 1/20 0.40

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
SCHEMBL12484084 0.84 POLB (0.40) ACHEPOLBSMN1; SMN2MEN1TP53
SCHEMBL14844978 0.81 ACHE (0.46) ACHEPOLBTSHRSMN1; SMN2PTPN1
SCHEMBL12485888 0.78 POLM (0.54) KDM4EMEN1HTR2AKMT2AALOX15
SCHEMBL4054448 0.78 INPPL1 (0.45) POLBKDM4EALDH1A1HPGDUSP2
SCHEMBL544041 0.76 ACHE (0.69) ACHEPOLBTSHRPTPN1KDM4E
SCHEMBL7033578 0.73 ACHE (0.53) ACHETSHRSMN1; SMN2PTPN1KDM4E
SCHEMBL31158157 0.72 CYP3A4 (0.48) POLBTSHRSMN1; SMN2KDM4EALDH1A1
SCHEMBL742810 0.71 ACHE (0.62) ACHEPOLBTSHRPTPN1KDM4E
SCHEMBL31229899 0.71 ACHE (0.62) ACHEPOLBTSHRPTPN1KDM4E
SCHEMBL1445775 0.71 CYP1A2 (0.40) POLBTSHRALDH1A1HPGDMEN1

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
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