SCHEMBL14355706

SCHEMBL14355706

COc1cc(CN)cc(CO)c1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ GRIN2D O15399 2/20 0.47
▸ GRIN3B O60391 2/20 0.47
▸ GRIN1 Q05586 2/20 0.47
▸ GRIN2A Q12879 2/20 0.47
▸ GRIN2B Q13224 2/20 0.47
▸ GRIN2C Q14957 2/20 0.47
▸ GRIN3A Q8TCU5 2/20 0.47
▸ DAO P14920 1/20 0.46
▸ MAOB P27338 3/20 0.42
▸ TAAR1 Q96RJ0 3/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ CYP19A1 P11511 1/20 0.40
▸ MAPT P10636 1/20 0.39
▸ CALM1 P0DP23 1/20 0.38
▸ AKR1B1 P15121 1/20 0.38
▸ CYP4F2 P78329 1/20 0.37
▸ CYP4A11 Q02928 1/20 0.37
▸ PTGS2 P35354 1/20 0.37

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
SCHEMBL18769324 0.89 GRIN2D (0.50) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL1621101 0.89 DAO (0.53) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL43448 0.84 ALDH1A1 (0.58) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL65276 0.84 ALDH1A1 (0.58) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
Hydrochloric Acid SCHEMBL2479666 0.82 ALDH1A1 (0.55) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL28123040 0.82 ALDH1A1 (0.55) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL8814719 0.82 ACHE (0.48) ALDH1A1
SCHEMBL10167473 0.82 ACHE (0.48) ALDH1A1
SCHEMBL8228443 0.81 DAO (0.47) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL1620230 0.79 GRIN2D (0.47) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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
US-7306884-B2 Dye-containing curable composition, color filter prepared using the same, and process of preparing color filter FUJIFILM CORPORATION (JP) 2007-12-11 — — US disclosed
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