SCHEMBL7357663

SCHEMBL7357663

CC(C)(C)CC(C)(C)NC(=O)C(O)[C@H](N)CC1CCCCC1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 16/20 0.56
METAP1 P53582 8/20 0.50
EPHX1 P07099 1/20 0.47
REN P00797 2/20 0.44
CPB2 Q96IY4 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
Hydrochloric Acid SCHEMBL7358994 0.99 METAP2 (0.55) METAP2METAP1EPHX1RENCPB2
SCHEMBL6477201 0.79 METAP2 (0.56) METAP2METAP1REN
SCHEMBL7358549 0.78 METAP2 (0.54) METAP2METAP1
SCHEMBL9514512 0.78 METAP2 (0.62) METAP2METAP1REN
SCHEMBL9514498 0.78 METAP2 (0.62) METAP2METAP1REN
SCHEMBL9514503 0.78 METAP2 (0.62) METAP2METAP1REN
Hydrochloric Acid SCHEMBL7353863 0.78 METAP2 (0.53) METAP2METAP1
SCHEMBL7361727 0.77 METAP2 (0.55) METAP2METAP1REN
SCHEMBL6475764 0.77 METAP2 (0.60) METAP2METAP1REN
SCHEMBL7341595 0.77 METAP2 (0.60) METAP2METAP1REN

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-6242494-B1 ANGIOGENESIS INHIBITORS, ANTITUMOR AGENTS, DIABETIC RETINOPATHY, AND ANTIINFLAMMATORY AGENTS ABBOTT LABORATORIES 2001-06-05 US claimed
US-6242494-B1 ANGIOGENESIS INHIBITORS, ANTITUMOR AGENTS, DIABETIC RETINOPATHY, AND ANTIINFLAMMATORY AGENTS ABBOTT LABORATORIES 2001-06-05 US disclosed