SCHEMBL9238271

SCHEMBL9238271

CC(C)(C)OC(=O)N1CCC(CC(=O)N2CCC(CC(=O)O)CC2)CC1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.50
PKM P14618 1/20 0.50
DDB1 Q16531 1/20 0.50
CRBN Q96SW2 1/20 0.50
HPGD P15428 1/20 0.48
SFRP1 Q8N474 1/20 0.47
GLS O94925 2/20 0.46
GPR119 Q8TDV5 2/20 0.46
RECQL P46063 1/20 0.46
EPHX1 P07099 1/20 0.46
FNTA P49354 1/20 0.45
FNTB P49356 1/20 0.45
TPSAB1 Q15661 1/20 0.44
TPSD1 Q9BZJ3 1/20 0.44
TPSG1 Q9NRR2 1/20 0.44
USP2 O75604 1/20 0.44
SMN1; SMN2 Q16637 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
SCHEMBL584378 0.94 KDM4E (0.54) KDM4EPKMHPGDGLSGPR119
SCHEMBL28063864 0.92 KDM4E (0.53) KDM4EPKMHPGDGLSGPR119
SCHEMBL9236134 0.92 HPGD (0.61) KDM4EPKMDDB1CRBNHPGD
SCHEMBL9234957 0.92 HPGD (0.61) KDM4EPKMDDB1CRBNHPGD
SCHEMBL13812235 0.90 HPGD (0.60) KDM4EPKMDDB1CRBNHPGD
SCHEMBL23212559 0.88 HPGD (0.55) KDM4EPKMHPGDGLSGPR119
SCHEMBL4649476 0.88 DDB1 (0.50) KDM4EPKMDDB1CRBNHPGD
SCHEMBL28573962 0.88 KDM4E (0.50) KDM4EPKMDDB1CRBNHPGD
SCHEMBL9236069 0.86 KDM4E (0.48) KDM4EPKMDDB1CRBNHPGD
SCHEMBL13812230 0.86 DDB1 (0.48) KDM4EPKMDDB1CRBNHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0638553-A1 Carboxylic acid amides having a terminal carboxylic acid group as aggregation inhibiting drugs Dr. Karl Thomae GmbH (DE) 1995-02-15 EP disclosed