SCHEMBL28536932

SCHEMBL28536932

NC1CCC(N)(Cc2ccccc2F)CC1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TAAR1 Q96RJ0 1/20 0.40
▸ MAOA P21397 3/20 0.39
▸ MAOB P27338 3/20 0.39
▸ IDO1 P14902 2/20 0.38
▸ OPRL1 P41146 1/20 0.37
▸ KDM1A O60341 6/20 0.36
▸ RCOR1 Q9UKL0 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.34
▸ AOC3 Q16853 1/20 0.34
▸ ATM Q13315 1/20 0.34
▸ KDM1B Q8NB78 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
SCHEMBL2474184 0.86 MAOA (0.52) TAAR1MAOAMAOBIDO1KDM1A
SCHEMBL4052580 0.80 OPRL1 (0.44) TAAR1MAOAMAOBIDO1OPRL1
Formic Acid SCHEMBL5135412 0.77 MAOB (0.43) TAAR1MAOAMAOBIDO1ALDH1A1
SCHEMBL8267928 0.75 DPP4 (0.44) TAAR1MAOAMAOBIDO1KDM1A
SCHEMBL7453823 0.74 ALDH1A1 (0.53) ALDH1A1
SCHEMBL28544407 0.72 MAOB (0.46) TAAR1MAOAMAOBIDO1KDM1A
SCHEMBL9957112 0.72 TAAR1 (0.36) TAAR1MAOAMAOBIDO1KDM1A
SCHEMBL3885819 0.71 GAA (0.47) ALDH1A1
SCHEMBL9957480 0.71 GRIN2B (0.40) TAAR1IDO1
SCHEMBL12821714 0.70 MAOB (0.56) TAAR1MAOAMAOBIDO1OPRL1

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
CN-108135175-B Bicyclic compounds and their use for inhibition of SUV39H2 肿瘤疗法科学股份有限公司 2021-04-06 — — CN disclosed
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