SCHEMBL7288696

SCHEMBL7288696

O=C1OCCC1N[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.52
CYP1A2 P05177 1/20 0.52
KMT2A Q03164 1/20 0.52
CTSL P07711 1/20 0.45
TACR1 P25103 1/20 0.43
CTSK P43235 3/20 0.42
CTSB P07858 2/20 0.42
CTSS P25774 2/20 0.42

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
SCHEMBL7296477 0.86 ACE (0.50) MEN1CYP1A2KMT2A
SCHEMBL10489583 0.81 FKBP1A (0.52)
SCHEMBL7513191 0.81 CTSL (0.67) CTSLCTSKCTSBCTSS
SCHEMBL7511180 0.79 MEN1 (0.63) MEN1CYP1A2KMT2A
SCHEMBL3169636 0.79 MEN1 (0.63) MEN1CYP1A2KMT2A
SCHEMBL6060180 0.79 MEN1 (0.63) MEN1CYP1A2KMT2A
SCHEMBL21787658 0.78 MEN1 (0.53) MEN1CYP1A2KMT2A
SCHEMBL7512878 0.75 CTSL (0.65) CTSLCTSKCTSBCTSS
SCHEMBL10420650 0.73 TACR1 (0.57) KMT2ACTSLTACR1CTSKCTSB
SCHEMBL7513937 0.72 MEN1 (0.55) MEN1CYP1A2KMT2ACTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4876359-A HYPOTENSIVE, ANGIOTENSIN ENZYME INHIBITOR SS PHARMACEUTICAL CO., LTD. (JP) 1989-10-24 US disclosed
EP-0266568-A2 Novel gamma-butyrolactone derivatives SS PHARMACEUTICAL CO., LTD. (JP) 1988-05-11 EP disclosed