SCHEMBL8321069

SCHEMBL8321069

Brc1ccc(OCc2ccccc2)cc1N1CCCCC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.50
NPC1 O15118 2/20 0.50
CASP3 P42574 1/20 0.50
SENP8 Q96LD8 1/20 0.50
SENP7 Q9BQF6 1/20 0.50
SENP6 Q9GZR1 1/20 0.50
LTA4H P09960 1/20 0.49
MAOB P27338 3/20 0.48
MAOA P21397 2/20 0.48
HRH3 Q9Y5N1 5/20 0.48
ALOX5 P09917 1/20 0.46
TSHR P16473 1/20 0.46
HSD17B10 Q99714 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
KCNH2 Q12809 1/20 0.45
MCHR1 Q99705 1/20 0.45
EGFR P00533 2/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
NPY1R P25929 1/20 0.44

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
SCHEMBL17659018 0.84 HTR1A (0.52) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL17659705 0.83 HTR1A (0.54) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL25846133 0.81 HRH3 (0.49) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL8319330 0.80 NPC1 (0.52) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL11102792 0.77 HRH3 (0.53) RAB9ANPC1HRH3SMN1; SMN2EGFR
SCHEMBL28071588 0.77 LTA4H (0.48) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL6813012 0.77 HRH3 (0.53) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL3103344 0.77 MAOB (0.57) LTA4HMAOBMAOAHRH3ALOX5
SCHEMBL17659748 0.77 SLC6A2 (0.56) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL9047395 0.76 LTA4H (0.60) RAB9ANPC1CASP3SENP8SENP7

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-0939754-A2 N-OXY-NAPHTHALIMIDES AS ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY (US) 1999-09-08 EP disclosed
WO-1998019648-A2 N-OXY-NAPHTHALIMIDES AS ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY (US) 1998-05-14 WO disclosed