SCHEMBL7301464

SCHEMBL7301464

CC(C)(C)OC(=O)C(N)C(F)(F)C(O)C(N)CC1CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 6/20 0.40
METAP1 P53582 4/20 0.40
REN P00797 5/20 0.38
CTSS P25774 1/20 0.38
CTSK P43235 1/20 0.38

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
SCHEMBL7303335 0.82 METAP2 (0.49) METAP2METAP1RENCTSSCTSK
SCHEMBL10346884 0.80 REN (0.39) METAP2METAP1RENCTSSCTSK
SCHEMBL10520251 0.79 REN (0.41) METAP2METAP1RENCTSSCTSK
SCHEMBL10445626 0.77 METAP2 (0.52) METAP2METAP1CTSSCTSK
SCHEMBL7429150 0.77 CTSK (0.44) METAP2METAP1RENCTSSCTSK
SCHEMBL20244849 0.76 CTSK (0.45) METAP2CTSSCTSK
SCHEMBL22090642 0.76 CTSK (0.45) METAP2CTSSCTSK
SCHEMBL7436405 0.76 REN (0.42) METAP2METAP1REN
SCHEMBL10521580 0.75 METAP2 (0.37) METAP2METAP1RENCTSSCTSK
SCHEMBL7294534 0.75 CTSL (0.47) METAP2METAP1RENCTSSCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0368719-B1 Novel analogs of peptidase substrates MERRELL PHARMA INC (US) 1997-01-08 EP disclosed
EP-0371179-A1 Novel analogs of peptidase substrates MERRELL DOW PHARMACEUTICALS INC. (US) 1990-06-06 EP disclosed
EP-0368719-A2 Novel analogs of peptidase substrates MERRELL PHARMACEUTICALS INC. (US) 1990-05-16 EP disclosed