SCHEMBL8612926

SCHEMBL8612926

COC1CC(CNC(C)=O)C(OC)O1

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MTNR1A P48039 6/20 0.32
▸ MTNR1B P49286 3/20 0.32
▸ FUCA1 P04066 1/20 0.31

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
SCHEMBL3575345 0.82 NQO2 (0.35) MTNR1AMTNR1B
SCHEMBL7407325 0.77 LGALS8 (0.34) —
SCHEMBL9404716 0.75 NLRP3 (0.34) —
SCHEMBL6438566 0.73 MGAM (0.30) —
SCHEMBL6936974 0.70 MTNR1A (0.38) MTNR1AMTNR1BFUCA1
SCHEMBL7486785 0.70 HTR2C (0.32) —
SCHEMBL6436811 0.70 — —
SCHEMBL8683152 0.69 — —
SCHEMBL271275 0.69 — —
SCHEMBL6936881 0.69 FUCA1 (0.39) MTNR1AFUCA1

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-5852017-A 2,3(1H,4H)-quinoxalinediones BASF AKTIENGESELLSCHAFT (DE) 1998-12-22 — — US disclosed
US-5714489-A 2,3(1H,4H)quinoxalinedione BASF AKTIENGESELLSCHAFT (DE) 1998-02-03 — — US disclosed
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