SCHEMBL7362837

SCHEMBL7362837

CCOC(=O)[C@H]1N[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 2/20 0.52
MMP1 P03956 1/20 0.49
MMP3 P08254 1/20 0.49
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
ALDH1A1 P00352 4/20 0.48
MMP8 P22894 1/20 0.47
CTSL P07711 1/20 0.46
CTSB P07858 1/20 0.46
P2RY12 Q9H244 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
CNR2 P34972 1/20 0.44
REN P00797 1/20 0.43

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 0.91 FPR2 (0.54) FPR2MMP1MMP3MEN1KMT2A
SCHEMBL9087713 0.87 CAPN1 (0.52) FPR2MMP1MMP3MEN1KMT2A
SCHEMBL7354780 0.84 LMNA (0.49) FPR2KMT2AALDH1A1MMP8L3MBTL1
SCHEMBL8308565 0.82 CTSL (0.51) FPR2MMP1MMP3KMT2AALDH1A1
SCHEMBL7357371 0.81 CYP3A4 (0.49) MEN1KMT2AALDH1A1CTSLCTSB
SCHEMBL7361795 0.80 L3MBTL1 (0.51) FPR2MEN1KMT2AALDH1A1P2RY12
SCHEMBL9087719 0.80 ITGA4 (0.50) FPR2ALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL7359406 0.79 MMP1 (0.49) MMP1MMP8L3MBTL1
SCHEMBL7356396 0.79 CAPN1 (0.53) FPR2MMP1MEN1KMT2AALDH1A1
SCHEMBL7360469 0.79 L3MBTL1 (0.44) FPR2ALDH1A1MMP8CTSLCTSB

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