SCHEMBL6175205

SCHEMBL6175205

O=c1oc(CCc2ccccc2)cc(O)c1C(C1CC1)C1CC1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR2B P41595 4/20 0.46
HTR3A P46098 1/20 0.46
DAO P14920 3/20 0.44
PPARG P37231 3/20 0.41
HSD17B3 P37058 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
STS P08842 1/20 0.35
PDE5A O76074 2/20 0.35
PDE3A Q14432 1/20 0.34

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
SCHEMBL6174697 0.86 HTR2B (0.43) HTR2BHTR3ADAOPPARGNPC1
SCHEMBL7480491 0.80 ELANE (0.33) DAO
SCHEMBL6173304 0.80 HTR2B (0.43) HTR2BHTR3ANPC1RAB9ASMN1; SMN2
SCHEMBL6174391 0.80 HTR2B (0.46) HTR2BHTR3ADAONPC1RAB9A
SCHEMBL6174618 0.79 HTR2B (0.37) HTR2BHTR3ADAO
SCHEMBL6175087 0.79 HTR2B (0.39) HTR2BHTR3ADAO
SCHEMBL6173485 0.79 HTR2B (0.37) HTR2BHTR3ADAOPPARG
SCHEMBL7396969 0.78 HTR2B (0.47) HTR2BHTR3ADAOPPARG
SCHEMBL6173151 0.77 CYP2C9 (0.52) HTR2BHTR3ADAOPPARG
SCHEMBL6173824 0.75 PPARG (0.47) HTR2BHTR3ADAOPPARGHSD17B3

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1203770-B1 Pyran-2-ones and 5,6-dihydropyran-2-ones useful for treating hyperplasia and other diseases UPJOHN CO (US) 2005-03-09 EP claimed
EP-0668860-B1 PYRAN-2-ONES AND 5,6-DIHYDROPYRAN-2-ONES USEFUL FOR TREATING HIV AND OTHER RETROVIRUSES UPJOHN CO (US) 2002-09-11 EP claimed
EP-1203770-A1 Pyran-2-ones and 5,6-dihydropyran-2-ones useful for treating hyperplasia and other diseases PHARMACIA & UPJOHN COMPANY (US) 2002-05-08 EP claimed
EP-0668860-A1 PYRAN-2-ONES AND 5,6-DIHYDROPYRAN-2-ONES USEFUL FOR TREATING HIV AND OTHER RETROVIRUSES PHARMACIA & UPJOHN COMPANY (US) 1995-08-30 EP claimed
WO-1994011361-A1 PYRAN-2-ONES AND 5,6-DIHYDROPYRAN-2-ONES USEFUL FOR TREATING HIV AND OTHER RETROVIRUSES THE UPJOHN COMPANY (US) 1994-05-26 WO claimed
EP-1203770-B1 Pyran-2-ones and 5,6-dihydropyran-2-ones useful for treating hyperplasia and other diseases UPJOHN CO (US) 2005-03-09 EP disclosed
EP-1203770-A1 Pyran-2-ones and 5,6-dihydropyran-2-ones useful for treating hyperplasia and other diseases PHARMACIA & UPJOHN COMPANY (US) 2002-05-08 EP disclosed
EP-0668860-A1 PYRAN-2-ONES AND 5,6-DIHYDROPYRAN-2-ONES USEFUL FOR TREATING HIV AND OTHER RETROVIRUSES PHARMACIA & UPJOHN COMPANY (US) 1995-08-30 EP disclosed
WO-1994011361-A1 PYRAN-2-ONES AND 5,6-DIHYDROPYRAN-2-ONES USEFUL FOR TREATING HIV AND OTHER RETROVIRUSES THE UPJOHN COMPANY (US) 1994-05-26 WO disclosed