SCHEMBL8962028

SCHEMBL8962028

Cc1cccc2oc3cc(F)ccc3c(=O)c12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 2/20 0.49
▸ ESR2 Q92731 2/20 0.49
▸ KDM5A P29375 1/20 0.49
▸ PARP1 P09874 1/20 0.48
▸ MAOA P21397 5/20 0.45
▸ MAOB P27338 2/20 0.44
▸ TTR P02766 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ NPC1 O15118 3/20 0.41
▸ RAB9A P51151 3/20 0.41
▸ CYP11B1 P15538 1/20 0.40
▸ CYP11B2 P19099 1/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ HCRTR1 O43613 1/20 0.40

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
SCHEMBL24726918 0.87 PARP1 (0.45) ESR1ESR2KDM5APARP1MAOA
SCHEMBL20275953 0.84 ESR1 (0.48) ESR1ESR2KDM5AMAOATTR
SCHEMBL8962095 0.81 AHR (0.53) ESR1ESR2KDM5AMAOATTR
SCHEMBL1794501 0.80 MAOA (0.63) KDM5AMAOAKDM4EALDH1A1GAA
SCHEMBL5781043 0.78 MAOA (0.67) PARP1MAOAMAOBTTRKDM4E
SCHEMBL24727004 0.77 GABRP (0.43) PARP1GAANPC1RAB9AMEN1
SCHEMBL8961883 0.77 MAOB (0.56) MAOAMAOBALDH1A1GAAHPGD
SCHEMBL17827855 0.77 MAPT (0.60) ESR1ESR2KDM5AMAOAMAOB
SCHEMBL20346703 0.75 MAOB (0.48) ESR1ESR2KDM5AMAOAMAOB
SCHEMBL20346698 0.75 AHR (0.43) ESR1ESR2KDM5AMAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5516794-A FOR THE TREATMENT OF BONE RESORPTION INVERNI DELLA BEEFA S.P.A. (IT) 1996-05-14 — — US disclosed
EP-0586960-B1 Xanthone derivatives, their preparation and use INVERNI DELLA BEFFA SPA (IT) 1996-02-07 — — EP disclosed
EP-0586960-A1 Xanthone derivatives, their preparation and use INVERNI DELLA BEFFA S.P.A. (IT) 1994-03-16 — — EP disclosed
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