SCHEMBL8965809

SCHEMBL8965809

CCc1cc(C(=O)c2ccc3c4c(ccc3c2)-c2ccccc2C4c2ccc(O)cc2)ccc1Br

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.45
ESR2 Q92731 2/20 0.45
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
CLK1 P49759 1/20 0.32
DYRK1A Q13627 1/20 0.32
DYRK1B Q9Y463 1/20 0.32
KDM4E B2RXH2 1/20 0.31
PTGS1 P23219 1/20 0.30
PTGS2 P35354 1/20 0.30

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
SCHEMBL8966507 0.79 ESR1 (0.42) ESR1ESR2MEN1KMT2ANPC1
SCHEMBL8966077 0.75 MEN1 (0.43) ESR1ESR2MEN1KMT2ANPC1
SCHEMBL8966091 0.72 ESR1 (0.57) ESR1ESR2NPC1RAB9APTGS2
SCHEMBL8965846 0.72 ESR1 (0.38) ESR1ESR2MEN1KMT2ANPC1
SCHEMBL9571847 0.72 ESR1 (0.37) ESR1ESR2MEN1KMT2ARAB9A
SCHEMBL8966522 0.70 SRD5A2 (0.43) ESR1ESR2MEN1KMT2ANPC1
SCHEMBL8966115 0.70 ESR1 (0.39) ESR1ESR2MEN1KMT2ANPC1
SCHEMBL7528005 0.68 MEN1 (0.42) ESR1ESR2MEN1KMT2AKDM4E
SCHEMBL7533104 0.67 ESR1 (0.45) ESR1ESR2MEN1KMT2AKDM4E
SCHEMBL8965802 0.65 MEN1 (0.44) ESR1ESR2MEN1KMT2ANPC1

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