SCHEMBL4054448

SCHEMBL4054448

Cc1c(OP(=O)(O)O)cccc1-c1ncncn1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ INPPL1 O15357 8/20 0.45
▸ INPP5A Q14642 4/20 0.45
▸ INPP5B P32019 2/20 0.45
▸ SRC P12931 5/20 0.37
▸ MAPT P10636 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ USP2 O75604 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ PDE3A Q14432 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ AKT1 P31749 1/20 0.36
▸ POLB P06746 1/20 0.33
▸ HTR2A P28223 2/20 0.32
▸ FBP1 P09467 1/20 0.32
▸ HTR1A P08908 1/20 0.32
▸ HTR2C P28335 1/20 0.32
▸ HTR2B P41595 1/20 0.32

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
SCHEMBL12483487 0.78 ACHE (0.49) MAPTKDM4EUSP2ALDH1A1HPGD
SCHEMBL27931086 0.75 INPPL1 (0.50) INPPL1INPP5AINPP5BSRCMAPT
SCHEMBL29429257 0.72 MAPT (0.67) INPPL1INPP5AINPP5BSRCMAPT
SCHEMBL759513 0.72 MAPT (0.67) INPPL1INPP5AINPP5BSRCMAPT
Phosphoric Acid SCHEMBL27473336 0.71 MAPT (0.65) INPPL1INPP5AINPP5BSRCMAPT
SCHEMBL4054451 0.70 INPPL1 (0.45) INPPL1INPP5AINPP5BSRCMAPT
SCHEMBL1445775 0.70 CYP1A2 (0.40) MAPTALDH1A1HPGDPOLB
SCHEMBL18135184 0.69 INPPL1 (0.55) INPPL1INPP5AINPP5BSRCMAPT
SCHEMBL3873601 0.69 INPPL1 (0.50) INPPL1INPP5AINPP5BSRCMAPT
SCHEMBL12485888 0.69 POLM (0.54) KDM4EHTR2A

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
WO-2009148192-A1 ALPHA HELIX MIMETICS AND METHODS RELATING THERETO PRISM BIOLAB CORPORATION (JP) 2009-12-10 — — WO claimed
WO-2009148192-A1 ALPHA HELIX MIMETICS AND METHODS RELATING THERETO PRISM BIOLAB CORPORATION (JP) 2009-12-10 — — WO disclosed
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