SCHEMBL4765934

SCHEMBL4765934

O=C(c1ccc(Cc2ccccc2)cc1)C1CCCN1C1CCNC1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 3/20 0.40
▸ LTA4H P09960 3/20 0.39
▸ SPHK2 Q9NRA0 1/20 0.38
▸ SPHK1 Q9NYA1 1/20 0.38
▸ HTR2C P28335 3/20 0.37
▸ HTR2B P41595 3/20 0.37
▸ HTR2A P28223 2/20 0.37
▸ HRH1 P35367 1/20 0.37
▸ PLA2G10 O15496 1/20 0.37
▸ PLA2G2A P14555 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36

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
SCHEMBL3841290 0.84 ALDH1A1 (0.47) MGLLLMNAALDH1A1
SCHEMBL4724233 0.83 HPGD (0.54) HTR2BLMNAALDH1A1
Hydrochloric Acid SCHEMBL3860311 0.83 ALDH1A1 (0.47) MGLLLMNAALDH1A1
SCHEMBL4764354 0.83 POLB (0.41) LMNAALDH1A1
SCHEMBL2884746 0.81 HRH3 (0.51) MGLL
SCHEMBL4889725 0.81 KCNH2 (0.42) ALDH1A1
SCHEMBL3797395 0.80 HRH3 (0.46) LMNAKDM4EALDH1A1
SCHEMBL2879390 0.79 RECQL (0.42) KDM4EALDH1A1
SCHEMBL4793576 0.79 MEN1 (0.40) ALDH1A1
SCHEMBL4791508 0.79 LMNA (0.42) LMNAALDH1A1

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-1994022-A2 N-SUBSTITUTED-AZACYCLYLAMINES AS HISTAMINE-3 ANTAGONISTS Wyeth a Corporation of the State of Delaware (US) 2008-11-26 — — EP disclosed
WO-2007108936-A2 N-SUBSTITUTED-AZACYCLYLAMINES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2007-09-27 — — WO disclosed
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