SCHEMBL27770395

SCHEMBL27770395

NCc1c[c]ccc1N1CCC(O)CC1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMARCA2 P51531 1/20 0.35
SMARCA4 P51532 1/20 0.35
PBRM1 Q86U86 1/20 0.35
NCF1 P14598 1/20 0.35
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
KMT2A Q03164 1/20 0.33
TPH1 P17752 1/20 0.32
LOXL2 Q9Y4K0 1/20 0.32
HSP90AA1 P07900 1/20 0.32
HSP90AB1 P08238 1/20 0.32
SMPD3 Q9NY59 1/20 0.31
KDM4E B2RXH2 1/20 0.31
KCNA3 P22001 1/20 0.30

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
SCHEMBL1815170 0.87 MAPT (0.33) SMARCA2SMARCA4PBRM1MAPTMEN1
SCHEMBL27749338 0.83 NCF1 (0.35) NCF1ALDH1A1KDM4E
SCHEMBL27749353 0.81 NCF1 (0.37) NCF1ALDH1A1
SCHEMBL16814993 0.80 NCF1 (0.54) SMARCA2SMARCA4PBRM1NCF1MAPT
SCHEMBL27770383 0.79 DRD2 (0.43) NCF1MAPTMEN1ALDH1A1KMT2A
SCHEMBL27865306 0.77 NCF1 (0.38) NCF1MAPTALDH1A1KDM4E
SCHEMBL188544 0.77 SLC18A3 (0.38) SMARCA2SMARCA4PBRM1MAPTMEN1
SCHEMBL2479088 0.73 KDM4E (0.39) MAPTMEN1ALDH1A1KMT2AKDM4E
SCHEMBL14758902 0.71 NCF1 (0.48) SMARCA2SMARCA4PBRM1NCF1MAPT
SCHEMBL1814332 0.71 GAA (0.36) ALDH1A1KDM4E

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101432284-A Dihydropyrazolopyrimidinone derivative BANYU PHARMA CO LTD (JP) 2009-05-13 CN disclosed