SCHEMBL8937033

SCHEMBL8937033

CC(NC(=O)C(CCCNC(=N)N)NC(=O)C(CCCNC(=N)N)NC(=O)C1CCCN1C(=O)C1CCCN1)C(=O)NC(CCCNC(=N)N)C(=O)NC(C(=O)NC(C(=O)O)C(C)O)C(C)C

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MAPK8 P45983 1/20 0.50
▸ MAPK9 P45984 1/20 0.50
▸ MAPK10 P53779 1/20 0.50
▸ EPHA2 P29317 2/20 0.44
▸ KDM1A O60341 2/20 0.43
▸ RAMP3 O60896 11/20 0.43
▸ CALCR P30988 11/20 0.43
▸ CALCRL Q16602 1/20 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
SCHEMBL8937042 1.00 MAPK8 (0.50) MAPK8MAPK9MAPK10EPHA2KDM1A
SCHEMBL8697957 0.85 CAPN1 (0.48) EPHA2RAMP3CALCRCALCRL
SCHEMBL8697990 0.85 CAPN1 (0.48) EPHA2RAMP3CALCRCALCRL
SCHEMBL30522057 0.85 KDM1A (0.52) MAPK8MAPK9MAPK10EPHA2KDM1A
SCHEMBL31410825 0.84 MAPK8 (0.56) MAPK8MAPK9MAPK10KDM1ARAMP3
SCHEMBL7163251 0.83 MAPK8 (0.40) MAPK8MAPK9MAPK10EPHA2KDM1A
SCHEMBL7163247 0.83 MAPK8 (0.40) MAPK8MAPK9MAPK10EPHA2KDM1A
SCHEMBL30844290 0.82 KDM1A (0.56) MAPK8MAPK9MAPK10KDM1A
SCHEMBL28758609 0.82 REN (0.44) MAPK8MAPK9MAPK10KDM1A
SCHEMBL30844398 0.82 MAPK8 (0.54) MAPK8MAPK9MAPK10EPHA2KDM1A

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-0673384-A4 POLYPEPTIDES USEFUL FOR TREATING INFLAMMATORY DISORDERS. UNIV MINNESOTA (US) 1996-10-09 — — EP claimed
EP-0673384-A1 POLYPEPTIDES USEFUL FOR TREATING INFLAMMATORY DISORDERS THE REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 1995-09-27 — — EP claimed
WO-1994013692-A1 POLYPEPTIDES USEFUL FOR TREATING INFLAMMATORY DISORDERS REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 1994-06-23 — — WO claimed
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