SCHEMBL13817563

SCHEMBL13817563

Cn1nc(C(=O)N2CCOCC2)cc1O

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.48
▸ TSHR P16473 1/20 0.48
▸ ESR2 Q92731 1/20 0.48
▸ RAB9A P51151 8/20 0.48
▸ NPC1 O15118 7/20 0.48
▸ SMN1; SMN2 Q16637 4/20 0.48
▸ MGLL Q99685 1/20 0.47
▸ ATM Q13315 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ MEN1 O00255 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ ALDH1A1 P00352 2/20 0.45
▸ TP53 P04637 2/20 0.45
▸ MAPK1 P28482 2/20 0.45
▸ GAA P10253 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ CYP1A2 P05177 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
SCHEMBL27249711 0.84 NR2E1 (0.56) HPGDTSHRESR2RAB9ANPC1
SCHEMBL15649920 0.83 SMN1; SMN2 (0.50) HPGDTSHRESR2RAB9ANPC1
SCHEMBL2214941 0.83 HPGD (0.50) HPGDTSHRESR2RAB9ANPC1
SCHEMBL17076827 0.81 HPGD (0.48) HPGDTSHRESR2RAB9ANPC1
SCHEMBL17473523 0.75 SMN1; SMN2 (0.48) HPGDTSHRRAB9ANPC1SMN1; SMN2
SCHEMBL12844927 0.73 SMN1; SMN2 (0.60) HPGDTSHRESR2RAB9ANPC1
SCHEMBL14930399 0.72 SMN1; SMN2 (0.51) HPGDRAB9ANPC1SMN1; SMN2ATM
SCHEMBL18483472 0.71 KMT2A (0.67) TSHRRAB9ANPC1SMN1; SMN2MAPT
SCHEMBL18748599 0.71 SMN1; SMN2 (0.53) HPGDTSHRESR2RAB9ANPC1
SCHEMBL14912963 0.71 SMN1; SMN2 (0.47) HPGDTSHRRAB9ANPC1SMN1; SMN2

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-7541459-B2 Method of producing amide compound FUJIFILM CORPORATION (JP) 2009-06-02 — — US disclosed
US-7541459-B2 Method of producing amide compound FUJIFILM CORPORATION (JP) 2009-06-02 — — US disclosed
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