SCHEMBL6011004

SCHEMBL6011004

Bc1ccccc1/C=C/C1CCNCC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC18A3 Q16572 1/20 0.36
▸ SIGMAR1 Q99720 1/20 0.36
▸ KHK P50053 1/20 0.35
▸ MAOA P21397 2/20 0.35
▸ MAOB P27338 1/20 0.35
▸ HRH1 P35367 2/20 0.33
▸ GBA1 P04062 1/20 0.33
▸ HTR2C P28335 3/20 0.33
▸ CHRM1 P11229 1/20 0.32
▸ CHRM3 P20309 1/20 0.32
▸ KDM1A O60341 1/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ LMNA P02545 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ SCN1A P35498 1/20 0.32
▸ SCN2A Q99250 1/20 0.32
▸ SCN3A Q9NY46 1/20 0.32
▸ BRD4 O60885 1/20 0.32
▸ CREBBP Q92793 1/20 0.32

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
SCHEMBL1476005 0.79 HTR2C (0.47) SLC18A3SIGMAR1KHKHTR2CKDM1A
SCHEMBL1476002 0.79 HTR2C (0.47) SLC18A3SIGMAR1KHKHTR2CKDM1A
SCHEMBL1477279 0.79 MAOA (0.54) MAOAMAOBKDM1ASLC6A2SLC6A4
SCHEMBL2719317 0.79 DYRK2 (0.40) SLC18A3SIGMAR1MAOAMAOBCHRM1
SCHEMBL2719321 0.79 DYRK2 (0.40) SLC18A3SIGMAR1MAOAMAOBCHRM1
SCHEMBL13794937 0.79 HTR2C (0.47) SLC18A3SIGMAR1KHKHTR2CKDM1A
SCHEMBL1477276 0.79 MAOA (0.54) MAOAMAOBKDM1ASLC6A2SLC6A4
Hydrochloric Acid SCHEMBL1476297 0.78 MAOA (0.52) MAOAMAOBKDM1ASLC6A2SLC6A4
Hydrochloric Acid SCHEMBL1476298 0.78 MAOA (0.52) MAOAMAOBKDM1ASLC6A2SLC6A4
SCHEMBL27587831 0.77 HRH1 (0.47) SLC18A3SIGMAR1HRH1CHRM1CHRM3

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-1785415-B1 PIPERIDINE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF ASTELLAS PHARMA INC (JP) 2012-05-02 — — EP disclosed
EP-1785415-A1 PIPERIDINE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF Astellas Pharma Inc. (JP) 2007-05-16 — — EP disclosed
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