SCHEMBL7450340

SCHEMBL7450340

CCOP(=O)(CN1CCCCC1)OCC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.48
TSHR P16473 3/20 0.44
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
GAA P10253 1/20 0.39
HTT P42858 1/20 0.39
PPARD Q03181 1/20 0.39
TDP1 Q9NUW8 2/20 0.34
TP53 P04637 2/20 0.34
ALDH1A1 P00352 4/20 0.34
KDM4E B2RXH2 2/20 0.34
POLB P06746 1/20 0.34
ANPEP P15144 1/20 0.33
ERAP2 Q6P179 1/20 0.33
PKM P14618 1/20 0.33
RAB9A P51151 1/20 0.33
LMNA P02545 1/20 0.31
HPGD P15428 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CA12 O43570 1/20 0.31

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
SCHEMBL1305572 0.98 TSHR (0.46) MAPTTSHRMEN1KMT2AGAA
SCHEMBL22014309 0.89 TSHR (0.50) MAPTTSHRMEN1KMT2AGAA
SCHEMBL13631583 0.82 TSHR (0.43) TSHRPPARDTDP1TP53ALDH1A1
SCHEMBL11032582 0.80 TSHR (0.50) TSHRMEN1KMT2AGAAPPARD
SCHEMBL7456931 0.80 TSHR (0.41) TSHRPPARDTDP1TP53ALDH1A1
SCHEMBL7505873 0.80 TSHR (0.41) TSHRMEN1KMT2APPARDTDP1
SCHEMBL1418450 0.80 TSHR (0.41) TSHRMEN1KMT2APPARDTDP1
SCHEMBL11138865 0.80 GAA (0.46) MAPTTSHRMEN1KMT2AGAA
SCHEMBL13992767 0.79 CXCR4 (0.46) TSHRMEN1KMT2APPARDTDP1
SCHEMBL24462561 0.79 PPARD (0.42) MAPTTSHRMEN1KMT2AGAA

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
WO-2001087888-A1 PYRAZOLOPYRIMIDINONE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE SK CHEMICALS CO., LTD. (KR) 2001-11-22 WO disclosed