SCHEMBL1901026

SCHEMBL1901026

CC(=O)NCC1CC2CC1CC2CNC(C)=O

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ FUCA1 P04066 1/20 0.39
▸ GLA P06280 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ ENGASE Q8NFI3 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ HIF1A Q16665 1/20 0.36
▸ CACNA1H O95180 1/20 0.35
▸ MTNR1A P48039 8/20 0.35
▸ MTNR1B P49286 7/20 0.35
▸ TSHR P16473 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.32
▸ DPP4 P27487 1/20 0.32
▸ PREP P48147 1/20 0.32
▸ FAP Q12884 1/20 0.32

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
SCHEMBL25097716 0.79 POLB (0.38) FUCA1GLANPSR1ENGASECACNA1H
SCHEMBL17249606 0.79 — —
SCHEMBL7909626 0.78 PKM (0.36) GLAMTNR1AMTNR1BTSHR
SCHEMBL21573802 0.77 — —
SCHEMBL17249604 0.77 — —
SCHEMBL21573785 0.77 — —
SCHEMBL26039089 0.76 KDM1A (0.40) —
SCHEMBL1866565 0.74 FUCA1 (0.40) FUCA1GLANPSR1ENGASEKDM4E
SCHEMBL10106984 0.74 CYP2C9 (0.49) FUCA1GLANPSR1ENGASEKDM4E
SCHEMBL22482094 0.73 FUCA1 (0.47) FUCA1GLANPSR1ENGASEKDM4E

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-2325167-A1 METHOD FOR PRODUCING CARBAMATE COMPOUND Ube Industries, Ltd. (JP) 2011-05-25 — — EP disclosed
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