SCHEMBL7259265

SCHEMBL7259265

CN(C)CCCN1CCN(C(=O)C2=CC=CC[CH]2)CC1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
BDKRB1 P46663 1/20 0.36
ACHE P22303 1/20 0.36
GRIN2B Q13224 1/20 0.36
P2RX7 Q99572 1/20 0.36
DRD2 P14416 5/20 0.35
HTR2A P28223 3/20 0.34
SIGMAR1 Q99720 1/20 0.34
CNR2 P34972 1/20 0.34
ALDH1A1 P00352 1/20 0.34
POLB P06746 1/20 0.34
ACKR3 P25106 1/20 0.33
SYK P43405 1/20 0.33

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
SCHEMBL8541103 0.73 HPGD (0.42) ALDH1A1POLB
SCHEMBL10086564 0.71 KCNA5 (0.56) ACHEDRD2HTR2ASIGMAR1ALDH1A1
SCHEMBL16299527 0.70 DRD2 (0.51) DRD2HTR2ASIGMAR1CNR2ALDH1A1
SCHEMBL16314493 0.70 DRD2 (0.51) CA1CA2DRD2HTR2ASIGMAR1
SCHEMBL15698486 0.69 CA1 (0.42) SLC2A1CA1CA2BDKRB1ACHE
SCHEMBL6767339 0.68 SLC2A1 (0.46) SLC2A1CA1CA2DRD2HTR2A
SCHEMBL27699518 0.67
SCHEMBL9434876 0.67 ALOX15 (0.50) DRD2HTR2AALDH1A1
SCHEMBL16353593 0.64 ACKR3 (0.46) SLC2A1BDKRB1SIGMAR1ACKR3
SCHEMBL26849999 0.64 HRH2 (0.42) CA1CA2POLB

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
WO-2003076408-A2 INDAZOLE DERIVATIVES THAT ARE ACTIVATORS OF SOLUBLE GUANYLATE CYCLASE ABBOTT LABORATORIES (US) 2003-09-18 WO disclosed