SCHEMBL7368676

SCHEMBL7368676

CC(C)C([C]=O)CC(O)C(N)CC1CCCCC1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
REN P00797 6/20 0.50
METAP2 P50579 5/20 0.39
METAP1 P53582 4/20 0.36
CTSK P43235 3/20 0.36
ALDH1A1 P00352 1/20 0.32
KMT2A Q03164 1/20 0.32
CTSL P07711 1/20 0.32
CTSB P07858 1/20 0.32

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
SCHEMBL7369089 1.00 REN (0.50) RENMETAP2METAP1CTSKALDH1A1
SCHEMBL7327540 0.81 REN (0.53) RENMETAP2METAP1CTSKALDH1A1
SCHEMBL8682141 0.79 REN (0.55) RENMETAP2METAP1ALDH1A1KMT2A
SCHEMBL7279876 0.79 REN (0.55) RENMETAP2METAP1ALDH1A1KMT2A
SCHEMBL8682444 0.79 REN (0.55) RENMETAP2METAP1ALDH1A1KMT2A
SCHEMBL7301121 0.77 REN (0.50) RENMETAP2METAP1ALDH1A1KMT2A
SCHEMBL9260290 0.77 REN (0.50) RENMETAP2METAP1ALDH1A1KMT2A
SCHEMBL7317656 0.77 REN (0.53) RENMETAP2METAP1ALDH1A1KMT2A
SCHEMBL7291539 0.77 REN (0.53) RENMETAP2METAP1
SCHEMBL7317650 0.77 REN (0.53) RENMETAP2METAP1ALDH1A1KMT2A

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
EP-0578745-A1 PHOSPHORUS CONTAINING COMPOUNDS AS INHIBITORS OF RETROVIRUSES THE UPJOHN COMPANY (US) 1994-01-19 EP claimed
WO-1992017490-A1 PHOSPHORUS CONTAINING COMPOUNDS AS INHIBITORS OF RETROVIRUSES THE UPJOHN COMPANY (US) 1992-10-15 WO claimed