SCHEMBL6477414

SCHEMBL6477414

CCOC(=O)CCC1CC[N]CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
TDP1 Q9NUW8 3/20 0.44
USP2 O75604 1/20 0.44
ALOX15 P16050 1/20 0.44
CYP1A2 P05177 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
KLK7 P49862 3/20 0.39
GAA P10253 2/20 0.39
MGAM O43451 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38
ATM Q13315 1/20 0.38
SMYD3 Q9H7B4 1/20 0.38
HPGD P15428 2/20 0.38
TRPA1 O75762 1/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL7453783 0.90 CYP1A2 (0.46) ALDH1A1TDP1USP2ALOX15CYP1A2
SCHEMBL9432340 0.88 ALDH1A1 (0.51) ALDH1A1TDP1USP2ALOX15CYP1A2
SCHEMBL18623243 0.87 ALDH1A1 (0.50) ALDH1A1TDP1USP2ALOX15CYP1A2
SCHEMBL7886952 0.83 ALDH1A1 (0.49) ALDH1A1TDP1USP2ALOX15CYP1A2
SCHEMBL2648207 0.83 MEN1 (0.51) ALDH1A1TDP1USP2ALOX15L3MBTL1
SCHEMBL9432178 0.82 NAAA (0.46)
SCHEMBL1172293 0.81 MEN1 (0.54) ALDH1A1TDP1USP2ALOX15L3MBTL1
SCHEMBL1377530 0.81 MGAM (0.41) ALDH1A1TDP1CYP1A2L3MBTL1GAA
SCHEMBL9744436 0.81 MEN1 (0.54) ALDH1A1TDP1USP2ALOX15L3MBTL1
SCHEMBL10073831 0.81 ALDH1A1 (0.46) ALDH1A1TDP1USP2ALOX15CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6962911-B2 Pyrrolopyrimidinone derivatives, process of preparation and use SK CHEMICALS CO., LTD. (KR) 2005-11-08 US disclosed
EP-1257553-B1 PYRROLOPYRIMIDINONE DERIVATIVES, PROCESS OF PREPARATION AND USE SK CHEMICALS CO LTD (KR) 2004-05-26 EP disclosed
EP-1257553-A1 PYRROLOPYRIMIDINONE DERIVATIVES, PROCESS OF PREPARATION AND USE SK Chemicals Co., Ltd. (KR) 2002-11-20 EP disclosed
WO-2001087888-A1 PYRAZOLOPYRIMIDINONE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE SK CHEMICALS CO., LTD. (KR) 2001-11-22 WO disclosed
WO-2001060825-A1 PYRROLOPYRIMIDINONE DERIVATIVES, PROCESS OF PREPARATION AND USE SK CHEMICALS CO., LTD. (KR) 2001-08-23 WO disclosed