SCHEMBL6569464

SCHEMBL6569464

C=C(C)C(=O)OC(C)CNc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.44
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
MTNR1A P48039 1/20 0.42
MTNR1B P49286 1/20 0.42
GAA P10253 1/20 0.42
HTT P42858 1/20 0.40
LMNA P02545 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
SCN1A P35498 1/20 0.39
SCN2A Q99250 1/20 0.39
SCN3A Q9NY46 1/20 0.39
ELANE P08246 1/20 0.39
MEN1 O00255 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
GPR174 Q9BXC1 1/20 0.38
HDAC3 O15379 1/20 0.38

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
SCHEMBL16594998 0.87 ALDH1A1 (0.40) MAPTALDH1A1KDM4ESMN1; SMN2MTNR1A
SCHEMBL863877 0.85 MAPT (0.42) MAPTALDH1A1KDM4ESMN1; SMN2GAA
SCHEMBL8069981 0.83 MAPT (0.38) MAPTALDH1A1KDM4ESMN1; SMN2MTNR1A
SCHEMBL5345228 0.82 MAPT (0.40) MAPTALDH1A1KDM4ESMN1; SMN2GAA
SCHEMBL11653130 0.81 HPGD (0.41) MAPTALDH1A1SMN1; SMN2GAAHTT
SCHEMBL3681972 0.79 LMNA (0.47) ALDH1A1LMNACYP1A2ELANERAB9A
SCHEMBL8203974 0.79 LMNA (0.53) ALDH1A1KDM4ESMN1; SMN2HTTLMNA
SCHEMBL305727 0.78 ALDH1A1 (0.45) MAPTALDH1A1KDM4ESMN1; SMN2GAA
SCHEMBL9189006 0.76 ALDH1A1 (0.37) MAPTALDH1A1KDM4ESMN1; SMN2GAA
SCHEMBL17891305 0.76 HPGD (0.41) MAPTALDH1A1SMN1; SMN2MTNR1AMTNR1B

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-1478403-A1 RESPONSIVE MICROGEL AND METHODS RELATED THERETO SUPRATEK PHARMA, INC. (CA) 2004-11-24 EP disclosed
WO-2003063909-A1 RESPONSIVE MICROGEL AND METHODS RELATED THERETO SUPRATEK PHARMA INC. (US) 2003-08-07 WO disclosed