SCHEMBL9769216

SCHEMBL9769216

CC(C)OC(=O)N1CCCC1C=O

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 1/20 0.41
▸ HCRTR2 O43614 7/20 0.39
▸ ACE P12821 4/20 0.36
▸ REN P00797 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ F2 P00734 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ LTA4H P09960 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ PEPD P12955 1/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ PTGS1 P23219 1/20 0.36
▸ HTR2A P28223 1/20 0.36
▸ PTGS2 P35354 1/20 0.36
▸ HRH1 P35367 1/20 0.36
▸ THPO P40225 1/20 0.36
▸ PMP22 Q01453 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ ACE2 Q9BYF1 1/20 0.36

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
SCHEMBL12018904 1.00 RAB9A (0.41) RAB9AHCRTR2ACERENKDM4E
SCHEMBL1861008 0.81 TSHR (0.42) RAB9AHCRTR2
SCHEMBL12952568 0.81 RAB9A (0.64) RAB9AHCRTR2
SCHEMBL13532420 0.79 RAB9A (0.43) RAB9AHCRTR2KDM4E
SCHEMBL12133179 0.79 RAB9A (0.43) RAB9AHCRTR2KDM4E
SCHEMBL8251925 0.78 DPP4 (0.44) —
SCHEMBL12001763 0.77 ACE (0.41) ACERENKDM4EF2LMNA
SCHEMBL12787401 0.77 GAA (0.42) RAB9AHCRTR2
SCHEMBL190173 0.77 HSD17B10 (0.49) LMNAMAPTHSD17B10
SCHEMBL12282720 0.77 POLB (0.58) RAB9AHCRTR2ACERENLMNA

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-4992534-A Anticarcinogenic agents with better water solubility, low toxicity, absorption and stability OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-02-12 — — US disclosed
EP-0303269-A2 2'-Deoxy-5-fluorouridine derivatives, process for preparing the same and the use thereof OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1989-02-15 — — EP disclosed
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