SCHEMBL4138929

SCHEMBL4138929

O=C(c1cc[c]cc1)N1CCC2(CC1)CCN(C1CCC1)CC2

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 6/20 0.58
L3MBTL3 Q96JM7 12/20 0.53
L3MBTL1 Q9Y468 10/20 0.53
MBTD1 Q05BQ5 5/20 0.52
TP53BP1 Q12888 2/20 0.52
L3MBTL4 Q8NA19 2/20 0.52
KDM4E B2RXH2 2/20 0.49
POLB P06746 1/20 0.49
ALDH1A1 P00352 1/20 0.49

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
SCHEMBL4930102 0.86 HRH3 (0.75) HRH3L3MBTL3L3MBTL1MBTD1TP53BP1
SCHEMBL4938741 0.84 HRH3 (0.58) HRH3L3MBTL3L3MBTL1MBTD1TP53BP1
SCHEMBL590136 0.81 L3MBTL3 (0.79) L3MBTL3L3MBTL1MBTD1TP53BP1L3MBTL4
SCHEMBL4147049 0.79 L3MBTL3 (0.67) HRH3L3MBTL3L3MBTL1MBTD1TP53BP1
SCHEMBL4130681 0.78 L3MBTL3 (0.66) HRH3L3MBTL3L3MBTL1MBTD1TP53BP1
SCHEMBL4139958 0.78 L3MBTL3 (0.66) HRH3L3MBTL3L3MBTL1MBTD1TP53BP1
SCHEMBL4134784 0.76 L3MBTL3 (0.60) HRH3L3MBTL3L3MBTL1MBTD1TP53BP1
SCHEMBL4136891 0.75 L3MBTL3 (0.62) HRH3L3MBTL3L3MBTL1MBTD1TP53BP1
SCHEMBL4282496 0.75 L3MBTL3 (0.58) HRH3L3MBTL3L3MBTL1MBTD1TP53BP1
SCHEMBL743038 0.74 HPGD (0.63) L3MBTL3POLBALDH1A1

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-2021004-A2 SUBSTITUTED AZASPIRO DERIVATIVES NEUROGEN CORPORATION (US) 2009-02-11 EP claimed
WO-2007133561-A2 SUBSTITUTED AZASPIRO DERIVATIVES NEUROGEN CORPORATION (US) 2007-11-22 WO claimed