SCHEMBL8966077

SCHEMBL8966077

O=C(c1ccc(O)cc1)c1ccc2c(c1)C(c1ccc(O)cc1)c1c-2ccc2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.43
KMT2A Q03164 5/20 0.43
RAB9A P51151 2/20 0.43
NPC1 O15118 1/20 0.43
ESR1 P03372 3/20 0.40
ESR2 Q92731 3/20 0.40
CLK1 P49759 1/20 0.40
DYRK1A Q13627 1/20 0.40
DYRK1B Q9Y463 1/20 0.40
MAPT P10636 3/20 0.39
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 1/20 0.39
GLA P06280 1/20 0.39
GAA P10253 1/20 0.39
CYP19A1 P11511 1/20 0.39
LMNA P02545 2/20 0.37
HSD17B1 P14061 1/20 0.37
HSD17B2 P37059 1/20 0.37
HTT P42858 2/20 0.37
PKM P14618 1/20 0.37

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
SCHEMBL8966115 0.88 ESR1 (0.39) MEN1KMT2ARAB9ANPC1ESR1
SCHEMBL8966522 0.80 SRD5A2 (0.43) MEN1KMT2ARAB9ANPC1ESR1
SCHEMBL8966375 0.78 ESR1 (0.46) MEN1KMT2ANPC1ESR1ESR2
SCHEMBL8965846 0.77 ESR1 (0.38) MEN1KMT2ARAB9ANPC1ESR1
SCHEMBL9571847 0.77 ESR1 (0.37) MEN1KMT2ARAB9AESR1ESR2
SCHEMBL7530844 0.76 KMT2A (0.40) MEN1KMT2AESR1ESR2MAPT
SCHEMBL8965809 0.75 ESR1 (0.45) MEN1KMT2ARAB9ANPC1ESR1
SCHEMBL7528055 0.73 MEN1 (0.40) MEN1KMT2AESR1ESR2MAPT
SCHEMBL7528005 0.73 MEN1 (0.42) MEN1KMT2AESR1ESR2MAPT
SCHEMBL7527912 0.72 ESR1 (0.46) MEN1KMT2ARAB9ANPC1ESR1

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
EP-0524742-B1 Benzo(a)fluorene compounds LILLY CO ELI (US) 1996-02-28 EP disclosed
EP-0524742-A2 Benzo(a)fluorene compounds ELI LILLY AND COMPANY (US) 1993-01-27 EP disclosed
US-5147880-A Estrogenic and antiestrogenic activity ELI LILLY AND COMPANY (US) 1992-09-15 US disclosed