SCHEMBL1225211

SCHEMBL1225211

O=C(O)c1cc(CCN2CCCC2)c[nH]1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.51
SLC6A3 Q01959 2/20 0.46
SIGMAR1 Q99720 3/20 0.45
HRH3 Q9Y5N1 7/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
MBTD1 Q05BQ5 1/20 0.41
L3MBTL3 Q96JM7 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
HTR1D P28221 1/20 0.38
HTR1B P28222 1/20 0.38
RAB9A P51151 2/20 0.38
GAA P10253 1/20 0.38
HRH4 Q9H3N8 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
SCHEMBL260284 0.80 KCNH2 (0.44) HRH3L3MBTL1HTR1DHTR1B
SCHEMBL260550 0.74 SLC6A3 (0.44) SLC6A3SIGMAR1HRH3L3MBTL1MBTD1
SCHEMBL261027 0.73 SLC6A3 (0.43) SLC6A3SIGMAR1HRH3L3MBTL1MBTD1
SCHEMBL6899153 0.73 DAO (0.60) DAOL3MBTL1TDP1RAB9AGAA
SCHEMBL1225699 0.73 DAO (0.60) DAOSLC6A3L3MBTL1TDP1CYP1A2
SCHEMBL1149656 0.71 DAO (0.73) DAORAB9AGAA
SCHEMBL7258022 0.70 DAO (0.57) DAOSIGMAR1HRH3TDP1RAB9A
SCHEMBL7772142 0.70 SLC6A3 (0.61) SLC6A3SIGMAR1HRH3L3MBTL1MBTD1
SCHEMBL1149201 0.70 DAO (0.49) DAOHRH3TDP1RAB9AGAA
SCHEMBL7031548 0.69 HRH3 (0.62) SLC6A3SIGMAR1HRH3L3MBTL1MBTD1

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-2281822-B1 New dihydroindolone derivatives, method of preparing same and pharmaceutical compositions containing them SERVIER LAB (FR) 2013-01-16 EP disclosed
EP-2281822-A1 New dihydroindolone derivatives, method of preparing same and pharmaceutical compositions containing them Les Laboratoires Servier (FR) 2011-02-09 EP disclosed