SCHEMBL7529248

SCHEMBL7529248

O=C1c2ccccc2C(=O)N1CCCOc1ccc(Cl)cc1Cl

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.56
MAPT P10636 2/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
XBP1 P17861 1/20 0.53
HPGD P15428 2/20 0.51
TSHR P16473 2/20 0.51
MAPK1 P28482 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
HTT P42858 2/20 0.49
THRB P10828 1/20 0.49
GLA P06280 1/20 0.49
KMT2A Q03164 2/20 0.49
TDP1 Q9NUW8 2/20 0.49
MAOA P21397 1/20 0.49
MAOB P27338 1/20 0.49
NPC1 O15118 2/20 0.49
HDAC7 Q8WUI4 1/20 0.48
LMNA P02545 2/20 0.48
MEN1 O00255 1/20 0.48
TP53 P04637 1/20 0.48

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
SCHEMBL1506144 0.81 ALDH1A1 (0.53) RAB9AMAPTSMN1; SMN2HPGDTSHR
SCHEMBL19691830 0.80 RAB9A (0.77) RAB9AMAPTSMN1; SMN2HPGDTSHR
SCHEMBL15018695 0.78 RAB9A (0.54) RAB9AMAPTSMN1; SMN2HPGDTSHR
SCHEMBL6494694 0.78 RAB9A (0.68) RAB9AMAPTSMN1; SMN2HPGDTSHR
SCHEMBL925181 0.77 RAB9A (0.62) RAB9AMAPTSMN1; SMN2HPGDTSHR
SCHEMBL12781082 0.76 TSHR (0.56) RAB9AHPGDTSHRMAPK1L3MBTL1
SCHEMBL4901340 0.76 HRH3 (0.47) RAB9AMAPTSMN1; SMN2HPGDTSHR
SCHEMBL7496666 0.76 RAB9A (0.66) RAB9AMAPTSMN1; SMN2HPGDL3MBTL1
SCHEMBL7529835 0.75 RAB9A (0.56) RAB9AMAPTSMN1; SMN2HPGDTSHR
SCHEMBL7075430 0.75 MAPT (0.56) RAB9AMAPTSMN1; SMN2HPGDGLA

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
EP-1190710-A1 PREVENTIVE OR THERAPEUTIC DRUGS FOR DIABETES SHIONOGI & CO., LTD. (JP) 2002-03-27 EP disclosed