SCHEMBL9819864

SCHEMBL9819864

CCOC(=O)N1CCN(CCCCc2ccccc2)CC1

nearest known ligand 0.92

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 6/20 0.69
HTR2A P28223 2/20 0.69
OPRM1 P35372 2/20 0.69
ADORA3 P0DMS8 1/20 0.69
HTR7 P34969 1/20 0.69
L3MBTL1 Q9Y468 1/20 0.65
HRH1 P35367 2/20 0.61
HRH2 P25021 1/20 0.61
HTR1A P08908 1/20 0.61
DRD4 P21917 1/20 0.61
TSHR P16473 2/20 0.58
MEN1 O00255 1/20 0.58
ALDH1A1 P00352 1/20 0.58
KMT2A Q03164 1/20 0.58
KCNA3 P22001 1/20 0.58
NPC1 O15118 1/20 0.57
RAB9A P51151 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
CCR3 P51677 1/20 0.56
GAA P10253 1/20 0.55

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
SCHEMBL10508433 0.87 HRH2 (0.63) SIGMAR1HTR2AOPRM1ADORA3HTR7
Hydrochloric Acid SCHEMBL10509615 0.86 HRH1 (0.61) SIGMAR1HTR2AOPRM1ADORA3HTR7
SCHEMBL9054221 0.85 L3MBTL1 (0.64) SIGMAR1HTR2AOPRM1ADORA3HTR7
SCHEMBL27564818 0.83 SIGMAR1 (0.76) SIGMAR1MEN1KMT2ACCR3FAAH
SCHEMBL27629467 0.83 SIGMAR1 (0.56) SIGMAR1HTR2AOPRM1ADORA3HTR7
SCHEMBL30671736 0.82 SIGMAR1 (0.70) SIGMAR1HTR7CCR3FAAH
SCHEMBL7475308 0.81 ALDH1A1 (0.70) L3MBTL1TSHRALDH1A1NPC1RAB9A
SCHEMBL9634840 0.81 SIGMAR1 (0.61) SIGMAR1HTR2AOPRM1ADORA3HTR7
SCHEMBL9744374 0.81 ALDH1A1 (0.57) SIGMAR1HTR2AOPRM1ADORA3HTR7
SCHEMBL4904424 0.81 SIGMAR1 (0.57) SIGMAR1HTR2AOPRM1ADORA3HTR7

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4987132-A PLATELET ACTIVATING FACTOR ANTAGONISTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1991-01-22 US disclosed
CN-1030415-A Saturated heterocycle carboxamide derivatives and its preparation method YAMANOUCHI PHARMA CO LTD (JP) 1989-01-18 CN disclosed
EP-0279681-A2 Saturated heterocyclic carboxamide derivatives YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1988-08-24 EP disclosed