SCHEMBL11400413

SCHEMBL11400413

CCc1cc([C]=O)[nH]c1CC

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ GRIN2D O15399 2/20 0.35
▸ GRIN3B O60391 2/20 0.35
▸ GRIN1 Q05586 2/20 0.35
▸ GRIN2A Q12879 2/20 0.35
▸ GRIN2B Q13224 2/20 0.35
▸ GRIN2C Q14957 2/20 0.35
▸ GRIN3A Q8TCU5 2/20 0.35
▸ DAO P14920 1/20 0.30

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
SCHEMBL891021 0.70 DAO (0.41) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL27402063 0.70 GRIN2D (0.39) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
Piperazine SCHEMBL28074633 0.63 KDM4E (0.35) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL11400539 0.62 — —
SCHEMBL11401866 0.61 DAO (0.38) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL11401624 0.61 — —
SCHEMBL3205225 0.57 GRIN2D (0.50) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL17968440 0.56 HSPA5 (0.35) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL9623007 0.56 GABRA1 (0.50) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL6832191 0.56 — —

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
EP-0032048-A1 Pyrroloylpyrrole derivatives, processes for their preparation and their use BEECHAM GROUP PLC (GB) 1981-07-15 — — EP claimed
EP-0032048-A1 Pyrroloylpyrrole derivatives, processes for their preparation and their use BEECHAM GROUP PLC (GB) 1981-07-15 — — EP disclosed
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