SCHEMBL7350104

SCHEMBL7350104

COc1ccc(CCNC(=O)C(O)[C@H](N)CCSC)cc1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.51
METAP2 P50579 2/20 0.47
KMT2A Q03164 3/20 0.47
GLA P06280 1/20 0.47
FNTA P49354 1/20 0.47
FNTB P49356 1/20 0.47
PGGT1B P53609 1/20 0.47
ALDH1A1 P00352 1/20 0.45
TAAR1 Q96RJ0 1/20 0.45
METAP1 P53582 1/20 0.45
CA2 P00918 1/20 0.45
FPR2 P25090 1/20 0.44

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 SCHEMBL7507006 0.99 SMN1; SMN2 (0.50) SMN1; SMN2METAP2KMT2AGLAFNTA
Hydrochloric Acid SCHEMBL7355464 0.99 SMN1; SMN2 (0.50) SMN1; SMN2METAP2KMT2AGLAFNTA
SCHEMBL7352540 0.88 METAP2 (0.51) METAP2METAP1
Hydrochloric Acid SCHEMBL7357119 0.87 METAP2 (0.50) METAP2METAP1
SCHEMBL7353083 0.83 METAP2 (0.47) SMN1; SMN2METAP2ALDH1A1METAP1CA2
SCHEMBL7358146 0.78 LAP3 (0.53) METAP2KMT2AFNTAFNTBPGGT1B
SCHEMBL7352471 0.78 LAP3 (0.53) METAP2KMT2AFNTAFNTBPGGT1B
SCHEMBL7360403 0.77 HDAC8 (0.48) SMN1; SMN2METAP2KMT2AFNTAFNTB
Hydrochloric Acid SCHEMBL7360809 0.77 LAP3 (0.52) METAP2KMT2AFNTAFNTBPGGT1B
SCHEMBL7354316 0.76 METAP2 (0.58) SMN1; SMN2METAP2ALDH1A1METAP1

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 6 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
EP-1073633-A2 SUBSTITUTED BETA-AMINO ACID INHIBITORS OF METHIONINE AMINOPEPTIDASE-2 ABBOTT LABORATORIES (US) 2001-02-07 EP claimed
WO-1999057098-A2 SUBSTITUTED BETA-AMINO ACID INHIBITORS OF METHIONINE AMINOPEPTIDASE-2 ABBOTT LABORATORIES (US) 1999-11-11 WO claimed
US-6242494-B1 ANGIOGENESIS INHIBITORS, ANTITUMOR AGENTS, DIABETIC RETINOPATHY, AND ANTIINFLAMMATORY AGENTS ABBOTT LABORATORIES 2001-06-05 US disclosed
EP-1073633-A2 SUBSTITUTED BETA-AMINO ACID INHIBITORS OF METHIONINE AMINOPEPTIDASE-2 ABBOTT LABORATORIES (US) 2001-02-07 EP disclosed
WO-1999057098-A2 SUBSTITUTED BETA-AMINO ACID INHIBITORS OF METHIONINE AMINOPEPTIDASE-2 ABBOTT LABORATORIES (US) 1999-11-11 WO disclosed