SCHEMBL7361795

SCHEMBL7361795

CCOC(=O)[C@H]1N[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)NN1CCCCC1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.51
FPR2 P25090 2/20 0.43
ATM Q13315 1/20 0.42
USP30 Q70CQ3 4/20 0.40
ALDH1A1 P00352 3/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
PSMB5 P28074 1/20 0.39
KDM4E B2RXH2 1/20 0.39
P2RY12 Q9H244 1/20 0.39
HSD17B10 Q99714 1/20 0.39
GAA P10253 1/20 0.39

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
SCHEMBL7354191 0.87 FPR2 (0.54) L3MBTL1FPR2ATMALDH1A1MEN1
SCHEMBL7360469 0.85 L3MBTL1 (0.44) L3MBTL1FPR2ALDH1A1HSD17B10GAA
SCHEMBL8307163 0.84 USP30 (0.42) L3MBTL1FPR2USP30ALDH1A1MEN1
SCHEMBL7387248 0.83 L3MBTL1 (0.64) L3MBTL1ALDH1A1PSMB5KDM4E
SCHEMBL7387251 0.83 L3MBTL1 (0.64) L3MBTL1ALDH1A1PSMB5KDM4E
SCHEMBL7354780 0.82 LMNA (0.49) L3MBTL1FPR2ALDH1A1KMT2AGAA
SCHEMBL7362252 0.82 MMP3 (0.50) L3MBTL1ATMMEN1KMT2APSMB5
SCHEMBL7359406 0.82 MMP1 (0.49) L3MBTL1ATM
SCHEMBL7356396 0.82 CAPN1 (0.53) FPR2USP30ALDH1A1MEN1KMT2A
SCHEMBL7362837 0.80 FPR2 (0.52) L3MBTL1FPR2ALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0753003-B1 AZIRIDINE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1999-06-16 EP disclosed
US-5668128-A INHIBITORS OF THIOL PROTEASE, PROPHYLAXIS AND TREATMENT OF BONE DISEASES, OSTEOPOROSIS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-09-16 US disclosed
EP-0753003-A1 AZIRIDINE DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1997-01-15 EP disclosed
WO-1995028416-A1 AZIRIDINE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1995-10-26 WO disclosed