SCHEMBL9744374

SCHEMBL9744374

CCOC(=O)N1CCN(CCCc2cccnc2)CC1

nearest known ligand 0.73

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.57
KDM4E B2RXH2 1/20 0.57
ALOX15 P16050 1/20 0.57
SIGMAR1 Q99720 2/20 0.57
HTR2A P28223 2/20 0.57
OPRM1 P35372 2/20 0.57
ADORA3 P0DMS8 1/20 0.57
HTR7 P34969 1/20 0.57
HRH1 P35367 9/20 0.56
HRH2 P25021 8/20 0.56
HTR1A P08908 1/20 0.50
DRD4 P21917 1/20 0.50
PTAFR P25105 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
USP2 O75604 1/20 0.48
TSHR P16473 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL15103054 0.86 KDM4E (0.55) ALDH1A1KDM4EALOX15SIGMAR1HTR2A
SCHEMBL17706209 0.84 KDM4E (0.53) ALDH1A1KDM4EALOX15SIGMAR1HTR2A
SCHEMBL9819864 0.81 SIGMAR1 (0.69) ALDH1A1SIGMAR1HTR2AOPRM1ADORA3
SCHEMBL6103099 0.78 SIGMAR1 (0.48) ALDH1A1KDM4EALOX15SIGMAR1HTR2A
SCHEMBL5715475 0.78 SIGMAR1 (0.46) ALDH1A1KDM4EALOX15SIGMAR1HTR2A
SCHEMBL5715116 0.78 KDM4E (0.45) ALDH1A1KDM4EALOX15SIGMAR1HTR2A
SCHEMBL6102814 0.78 KDM4E (0.47) ALDH1A1KDM4EALOX15SIGMAR1HTR2A
SCHEMBL5715419 0.78 KDM4E (0.47) ALDH1A1KDM4EALOX15SIGMAR1HTR2A
SCHEMBL5715230 0.78 KDM4E (0.46) ALDH1A1KDM4EALOX15SIGMAR1HTR2A
SCHEMBL27492297 0.78 CHRNA7 (0.55)

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-5144035-A Chemical intermediates for platelet activating factor antagonists YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1992-09-01 US disclosed
US-4948795-A PLATELET ACTIVATING FACTOR ANTAGONISTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1990-08-14 US disclosed
EP-0350145-A2 Pyridylthiazolidine carboxamide derivatives and their intermediates and production of both YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1990-01-10 EP disclosed