SCHEMBL8962095

SCHEMBL8962095

Cc1cccc2oc3cc(Cl)ccc3c(=O)c12

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 3/20 0.53
▸ TTR P02766 3/20 0.50
▸ CA1 P00915 4/20 0.47
▸ CA2 P00918 4/20 0.47
▸ ESR1 P03372 1/20 0.46
▸ KDM5A P29375 1/20 0.46
▸ ESR2 Q92731 1/20 0.46
▸ MCL1 Q07820 1/20 0.44
▸ CA12 O43570 1/20 0.43
▸ CA9 Q16790 1/20 0.43
▸ MAOA P21397 5/20 0.42
▸ HTR1A P08908 1/20 0.42
▸ HTR7 P34969 1/20 0.42
▸ HTR6 P50406 1/20 0.42
▸ NPC1 O15118 1/20 0.41
▸ RAB9A P51151 1/20 0.41

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
SCHEMBL2966509 0.87 AHR (0.59) AHRTTRCA1CA2MCL1
SCHEMBL20275953 0.84 ESR1 (0.48) TTRESR1KDM5AESR2MAOA
SCHEMBL8962028 0.81 ESR1 (0.49) TTRESR1KDM5AESR2MAOA
SCHEMBL1794501 0.80 MAOA (0.63) KDM5AMAOANPC1RAB9A
SCHEMBL29465920 0.79 TTR (0.71) AHRTTRCA1CA2MCL1
SCHEMBL11728871 0.79 TTR (0.71) AHRTTRCA1CA2MCL1
SCHEMBL237891 0.78 AHR (0.79) AHRTTRCA1CA2MAOA
SCHEMBL8961941 0.77 TTR (0.59) AHRTTRCA1CA2MCL1
SCHEMBL17827855 0.77 MAPT (0.60) ESR1KDM5AESR2CA12CA9
SCHEMBL584924 0.74 CNR1 (0.44) AHRTTRCA1CA2HTR1A

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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