SCHEMBL6612781

SCHEMBL6612781

O=C1CNC(=O)C2(CCN(CCc3ccccc3)CC2)N1CCc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.53
CHRM2 P08172 1/20 0.53
ADRA2A P08913 1/20 0.53
CYP2D6 P10635 1/20 0.53
TSHR P16473 1/20 0.53
DRD1 P21728 1/20 0.53
MAPT P10636 1/20 0.52
KMT2A Q03164 1/20 0.52
SIGMAR1 Q99720 8/20 0.47
OPRM1 P35372 4/20 0.46
OPRD1 P41143 1/20 0.46
OPRK1 P41145 1/20 0.46
OPRL1 P41146 1/20 0.46
HTR2A P28223 3/20 0.45
HTR2C P28335 3/20 0.45
HTR2B P41595 3/20 0.45
DRD2 P14416 2/20 0.45
SLC6A3 Q01959 1/20 0.45

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
SCHEMBL6613037 0.94 SIGMAR1 (0.49) LMNACHRM2ADRA2ACYP2D6TSHR
SCHEMBL6611036 0.93 CCR5 (0.52) LMNACHRM2ADRA2ACYP2D6TSHR
SCHEMBL6612763 0.93 CCR5 (0.52) LMNACHRM2ADRA2ACYP2D6TSHR
SCHEMBL6613998 0.93 OPRL1 (0.56) LMNACHRM2ADRA2ACYP2D6TSHR
SCHEMBL6612028 0.93 LMNA (0.51) LMNACHRM2ADRA2ACYP2D6TSHR
SCHEMBL6608842 0.92 CCR5 (0.53) SIGMAR1
SCHEMBL6613810 0.90 BDKRB2 (0.46) LMNACHRM2ADRA2ACYP2D6TSHR
SCHEMBL6612337 0.89 LMNA (0.48) LMNACHRM2ADRA2ACYP2D6TSHR
SCHEMBL6612492 0.88 HTR1A (0.46) LMNACHRM2ADRA2ACYP2D6TSHR
SCHEMBL6612040 0.87 DRD3 (0.56) ADRA2ADRD1HTR2AHTR2BDRD2

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-1236726-B1 TRIAZASPIRO 5.5]UNDECANE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO (JP) 2004-12-01 EP disclosed
EP-1236726-A1 TRIAZASPIRO 5.5]UNDECANE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2002-09-04 EP disclosed