SCHEMBL6173554

SCHEMBL6173554

Cc1cc(O)c(C(Cc2ccccc2)Cc2ccccc2)c(=O)o1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.47
MCL1 Q07820 1/20 0.47
ALDH1A1 P00352 5/20 0.46
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
HTT P42858 1/20 0.44
PTGES O14684 1/20 0.43
GAA P10253 2/20 0.42
ALOX12 P18054 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MAOA P21397 1/20 0.41
NQO1 P15559 1/20 0.40
ELANE P08246 2/20 0.39
CYP2C9 P11712 1/20 0.39
HTR2B P41595 1/20 0.39
HTR3A P46098 1/20 0.39

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
SCHEMBL7408954 0.86 MAPT (0.53) MAPTMCL1ALDH1A1MEN1KMT2A
SCHEMBL9196087 0.81 MTNR1A (0.42) MAPTMCL1ALDH1A1MEN1KMT2A
SCHEMBL6174415 0.77 CYP2C9 (0.58) MAPTMCL1ALDH1A1MEN1KMT2A
SCHEMBL6174074 0.76 SIGMAR1 (0.36) ALDH1A1SMN1; SMN2NQO1CYP2C9HTR2B
SCHEMBL6174518 0.76 VKORC1 (0.55) MAPTMCL1ALDH1A1MEN1KMT2A
SCHEMBL6175677 0.75 PGAM1 (0.47) MAPTMCL1ALDH1A1MEN1KMT2A
SCHEMBL6173543 0.74 CYP2C9 (0.55) ALDH1A1MEN1KMT2ANQO1CYP2C9
SCHEMBL6175609 0.73 CYP2C9 (0.54) ALDH1A1MEN1KMT2ANQO1CYP2C9
SCHEMBL6173602 0.73 CYP2C9 (0.54) ALDH1A1MEN1KMT2ANQO1CYP2C9
SCHEMBL6175124 0.73 CYP2C9 (0.54) ALDH1A1MEN1KMT2ANQO1CYP2C9

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 7 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 disclosed
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 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
CN-1040321-C Pyran-2-ones and 5,6-dihydropyran-2-ones useful for treating HIV and other retroviruses UPJOHN CO (US) 1998-10-21 CN 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
CN-1090279-A Be used for the treatment of HIV and other retroviral pyran-2-ones and 5,6-dihydropyrane-2-ketone UPJOHN CO (US) 1994-08-03 CN 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