SCHEMBL11390075

SCHEMBL11390075

CN1CCN(CCOc2ccc3c(c2)c(=O)c2ccccc2n3C)CC1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ XDH P47989 2/20 0.56
▸ SIGMAR1 Q99720 3/20 0.54
▸ HRH3 Q9Y5N1 2/20 0.50
▸ DRD3 P35462 1/20 0.50
▸ LTA4H P09960 1/20 0.50
▸ KMT2A Q03164 2/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ L3MBTL1 Q9Y468 2/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ RAD52 P43351 1/20 0.47
▸ ABCB1 P08183 2/20 0.46
▸ HTR5A P47898 1/20 0.46
▸ P2RY12 Q9H244 1/20 0.45
▸ MAOB P27338 1/20 0.45

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
SCHEMBL11387442 0.92 XDH (0.54) XDHSIGMAR1HRH3LTA4HL3MBTL1
SCHEMBL11389372 0.91 HRH3 (0.55) XDHSIGMAR1HRH3MAOB
SCHEMBL11383329 0.88 RAD52 (0.61) SIGMAR1LTA4HKMT2AMEN1L3MBTL1
SCHEMBL1795765 0.85 SIGMAR1 (0.56) SIGMAR1HRH3LTA4HKDM4EMAOB
SCHEMBL1795398 0.85 SIGMAR1 (0.53) SIGMAR1HRH3KDM4EMAOB
SCHEMBL11383666 0.85 HRH3 (0.63) XDHSIGMAR1HRH3MAOB
SCHEMBL11384862 0.84 XDH (0.57) XDHHRH3LTA4HL3MBTL1MAOB
SCHEMBL1793194 0.84 SIGMAR1 (0.57) SIGMAR1HRH3MAOB
SCHEMBL1795459 0.83 SIGMAR1 (0.52) XDHSIGMAR1HRH3MAOB
SCHEMBL1794312 0.83 SIGMAR1 (0.49) XDHSIGMAR1HRH3MAOB

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
US-4244954-A Acridine compounds and methods of combatting viruses with them STERLING DRUG INC. (US) 1981-01-13 — — US disclosed
US-4150134-A Aminoalkoxy substituted 9(aryl or aralkyl)-acridines STERLING DRUG INC. (US) 1979-04-17 — — US disclosed
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