SCHEMBL27989822

SCHEMBL27989822

O=C(OCc1cccc(F)c1)C1CCCN1C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ FKBP1A P62942 13/20 0.53
▸ MAOA P21397 2/20 0.50
▸ MAOB P27338 2/20 0.50
▸ HCAR2 Q8TDS4 1/20 0.47
▸ GRIN2B Q13224 1/20 0.44
▸ DPP4 P27487 1/20 0.44
▸ DPP8 Q6V1X1 1/20 0.44
▸ DPP9 Q86TI2 1/20 0.44
▸ DPP7 Q9UHL4 1/20 0.44

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
SCHEMBL28351585 0.86 FKBP1A (0.67) FKBP1A
SCHEMBL11443635 0.86 FKBP1A (0.67) FKBP1A
SCHEMBL28270373 0.86 FKBP1A (0.56) FKBP1A
SCHEMBL27989692 0.85 FKBP1A (0.54) FKBP1A
SCHEMBL28270410 0.84 FKBP1A (0.59) FKBP1A
SCHEMBL28811887 0.82 FKBP1A (0.73) FKBP1A
SCHEMBL3786414 0.82 FKBP1A (0.73) FKBP1A
SCHEMBL28431477 0.78 FKBP1A (0.60) FKBP1A
SCHEMBL28270469 0.78 FKBP1A (0.48) FKBP1A
SCHEMBL28271980 0.78 FKBP1A (0.57) FKBP1A

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
CN-109232713-A Nmda receptor regulator and application thereof 西北大学 2019-01-18 — — CN disclosed
CN-104321071-A Nmda receptor modulators and uses thereof UNIV NORTHWESTERN 2015-01-28 — — CN disclosed
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