SCHEMBL6185030

SCHEMBL6185030

C=CC(C1=C(O)CC(CCC)(c2ccccc2)OC1=O)c1cccc(OCc2ccccc2)c1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NAAA Q02083 1/20 0.36
ALOX5 P09917 1/20 0.36
ADAM17 P78536 2/20 0.36
MAOB P27338 2/20 0.36
MEN1 O00255 1/20 0.36
BCHE P06276 4/20 0.35
HPD P32754 1/20 0.35
RIPK1 Q13546 1/20 0.35

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
SCHEMBL9289119 0.94 MLNR (0.37) KMT2ASMN1; SMN2NAAAALOX5ADAM17
SCHEMBL9283987 0.89 HPD (0.33) KMT2ASMN1; SMN2NAAAMAOBBCHE
SCHEMBL6175094 0.89 SMN1; SMN2 (0.36) KMT2ASMN1; SMN2NAAAALOX5ADAM17
SCHEMBL6175689 0.85 EGFR (0.36) KMT2AMEN1
SCHEMBL6175466 0.80 SMN1; SMN2 (0.39) KMT2ASMN1; SMN2NAAAADAM17MAOB
SCHEMBL9195529 0.79 SMN1; SMN2 (0.36) KMT2ASMN1; SMN2NAAAALOX5ADAM17
SCHEMBL27431263 0.79 EGFR (0.36)
SCHEMBL6174313 0.77 EGFR (0.37) KMT2AMEN1
SCHEMBL6175098 0.76 MAOB (0.40) KMT2ANAAAADAM17MAOBMEN1
SCHEMBL6175092 0.76 MAOB (0.40) KMT2ANAAAADAM17MAOBMEN1

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 4 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
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