SCHEMBL6011987

SCHEMBL6011987

Cc1ccc(/C=C/C2CCN(C(=O)CN3CC(C)C(C)C3)CC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOB P27338 12/20 0.51
NPC1 O15118 2/20 0.44
ALDH1A1 P00352 2/20 0.44
HPGD P15428 2/20 0.44
RAB9A P51151 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
LMNA P02545 2/20 0.41
MAPT P10636 2/20 0.41
KDM4E B2RXH2 1/20 0.41
GPR183 P32249 1/20 0.40
MAOA P21397 2/20 0.38
USP2 O75604 1/20 0.38

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
SCHEMBL14261857 0.89 MAOB (0.50) MAOBNPC1ALDH1A1HPGDRAB9A
SCHEMBL6011966 0.87 MAOB (0.52) MAOBNPC1ALDH1A1HPGDRAB9A
SCHEMBL6011774 0.85 ALDH1A1 (0.53) MAOBNPC1ALDH1A1RAB9ASMN1; SMN2
SCHEMBL10069270 0.85 MAOB (0.50) MAOBNPC1ALDH1A1HPGDRAB9A
SCHEMBL14261840 0.82 GPR119 (0.48) MAOBNPC1ALDH1A1RAB9ASMN1; SMN2
SCHEMBL6011718 0.81 MAOB (0.53) MAOBNPC1ALDH1A1HPGDRAB9A
SCHEMBL10069713 0.81 ALDH1A1 (0.49) MAOBNPC1ALDH1A1RAB9ASMN1; SMN2
SCHEMBL14261826 0.81 MAOB (0.44) MAOBNPC1ALDH1A1HPGDRAB9A
SCHEMBL10068861 0.81 MAOB (0.44) MAOBNPC1ALDH1A1HPGDRAB9A
SCHEMBL14261822 0.80 TSHR (0.48) MAOBNPC1ALDH1A1SMN1; SMN2LMNA

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
EP-1785415-B1 PIPERIDINE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF ASTELLAS PHARMA INC (JP) 2012-05-02 EP disclosed