SCHEMBL8016459

SCHEMBL8016459

CCOP(=O)(CC(=O)CNC(=O)OC(C)(C)C)OCC

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.39
ALDH1A1 P00352 3/20 0.39
MEN1 O00255 2/20 0.39
TSHR P16473 2/20 0.39
TDP1 Q9NUW8 1/20 0.38
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
GAA P10253 1/20 0.36
HSD17B10 Q99714 1/20 0.35
PPARD Q03181 1/20 0.34
CA12 O43570 5/20 0.33
CA1 P00915 4/20 0.33
CA2 P00918 4/20 0.33
CA9 Q16790 3/20 0.33
EPHX1 P07099 1/20 0.33
CTSS P25774 1/20 0.33
CTSK P43235 1/20 0.33
CA14 Q9ULX7 2/20 0.33
CA7 P43166 1/20 0.33

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
SCHEMBL6053122 0.81 MEN1 (0.38) KMT2AALDH1A1MEN1TSHRTDP1
SCHEMBL9156326 0.80 TDP1 (0.36) KMT2AALDH1A1MEN1TSHRTDP1
SCHEMBL7820712 0.80 TDP1 (0.42) KMT2AALDH1A1MEN1TSHRTDP1
SCHEMBL9197708 0.79 TDP1 (0.41) KMT2AALDH1A1MEN1TSHRTDP1
SCHEMBL9154472 0.78 KMT2A (0.41) KMT2AALDH1A1MEN1TSHRTDP1
SCHEMBL3439097 0.78 KMT2A (0.40) KMT2AALDH1A1MEN1TSHRTDP1
SCHEMBL4714065 0.77 TDP1 (0.52) KMT2AALDH1A1MEN1TSHRTDP1
SCHEMBL13546218 0.76 TDP1 (0.39) KMT2AALDH1A1MEN1TSHRTDP1
SCHEMBL1696854 0.76 TDP1 (0.47) KMT2AALDH1A1MEN1TSHRTDP1
SCHEMBL9154376 0.76 EPHX1 (0.43) KMT2AALDH1A1MEN1TSHRGAA

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-6100264-A 5H, 10H-imidazo [1,2-A] indeno [1,2-E] pyrazin-4-one derivatives, their preparation, their intermediates and medicaments containing them RHONE-POULENC RORER, S.A. (FR) 2000-08-08 US disclosed
US-5990108-A USEFUL AS ANTAGONISTS OF THE ALPHA-AMINO-3-HYDROXY-5-METHYL-4-ISOXAZOLEPROPIONIC ACID (AMPA) RECEPTOR, ALSO KNOWN AS THE QUISQUALATE RECEPTOR, AND AS ANTAGONISTS OF THE N-METHYL-D-ASPARTATE (NMDA) RECEPTOR RHONE POULENC RORER S.A. (FR) 1999-11-23 US disclosed