SCHEMBL11383041

SCHEMBL11383041

Cn1c2ccccc2c(=O)c2ccc(OCCN3CCOCC3)cc21

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ RAD52 P43351 1/20 0.55
▸ L3MBTL1 Q9Y468 1/20 0.55
▸ FGFR1 P11362 1/20 0.52
▸ SRC P12931 1/20 0.52
▸ MCHR1 Q99705 1/20 0.52
▸ MAPK14 Q16539 1/20 0.52
▸ NPC1 O15118 2/20 0.51
▸ RAB9A P51151 1/20 0.51
▸ KDM4E B2RXH2 1/20 0.51
▸ ALDH1A1 P00352 1/20 0.51
▸ BCHE P06276 1/20 0.51
▸ ACHE P22303 1/20 0.51
▸ LTA4H P09960 1/20 0.50
▸ MAOB P27338 1/20 0.50
▸ XDH P47989 2/20 0.49
▸ CCR4 P51679 1/20 0.49
▸ P2RY12 Q9H244 1/20 0.48

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
SCHEMBL11383329 0.93 RAD52 (0.61) RAD52L3MBTL1FGFR1SRCMCHR1
SCHEMBL11384862 0.90 XDH (0.57) L3MBTL1MCHR1BCHEACHELTA4H
SCHEMBL1796429 0.83 MAOB (0.56) KDM4EBCHEACHEMAOBXDH
SCHEMBL1792736 0.83 MAOB (0.53) MCHR1BCHEACHEMAOBXDH
SCHEMBL11387442 0.82 XDH (0.54) L3MBTL1MCHR1BCHEACHELTA4H
SCHEMBL1793217 0.82 MAOB (0.58) MAOBXDH
SCHEMBL11390075 0.81 XDH (0.56) RAD52L3MBTL1KDM4EALDH1A1LTA4H
SCHEMBL11389372 0.81 HRH3 (0.55) MCHR1BCHEACHEMAOBXDH
SCHEMBL1794312 0.81 SIGMAR1 (0.49) BCHEACHEMAOBXDH
SCHEMBL1795459 0.81 SIGMAR1 (0.52) BCHEACHEMAOBXDH

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
US-4244954-A Acridine compounds and methods of combatting viruses with them STERLING DRUG INC. (US) 1981-01-13 — — US disclosed
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