SCHEMBL7531367

SCHEMBL7531367

COc1ccc2c3c(ccc2c1)-c1cc(OC)c(F)cc1C3c1ccc(O)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 5/20 0.44
ESR2 Q92731 5/20 0.44
PTPN1 P18031 1/20 0.38
TUBB4A P04350 1/20 0.37
TUBB P07437 1/20 0.37
TUBA3C P0DPH7 1/20 0.37
TUBA1B P68363 1/20 0.37
TUBA4A P68366 1/20 0.37
TUBB4B P68371 1/20 0.37
TUBB3 Q13509 1/20 0.37
TUBB2A Q13885 1/20 0.37
TUBB8 Q3ZCM7 1/20 0.37
TUBA3E Q6PEY2 1/20 0.37
TUBA1A Q71U36 1/20 0.37
TUBA1C Q9BQE3 1/20 0.37
TUBB6 Q9BUF5 1/20 0.37
TUBB2B Q9BVA1 1/20 0.37
TUBB1 Q9H4B7 1/20 0.37
DPP4 P27487 2/20 0.37
CYP3A4 P08684 2/20 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
SCHEMBL7535540 0.91 ESR1 (0.47) ESR1ESR2PTPN1TUBB4ATUBB
SCHEMBL7527845 0.88 ESR1 (0.45) ESR1ESR2PTPN1TUBB4ATUBB
SCHEMBL7523887 0.87 ESR1 (0.44) ESR1ESR2PTPN1TUBB4ATUBB
SCHEMBL7526863 0.87 ESR1 (0.38) ESR1ESR2CYP19A1KDM4EALDH1A1
SCHEMBL8966236 0.86 ESR1 (0.53) ESR1ESR2PTPN1TUBB4ATUBB
SCHEMBL7533104 0.85 ESR1 (0.45) ESR1ESR2PTPN1TUBB4ATUBB
SCHEMBL7534293 0.85 ESR1 (0.47) ESR1ESR2PTPN1TUBB4ATUBB
SCHEMBL7527079 0.83 ESR1 (0.42) ESR1ESR2DPP4KDM4EALDH1A1
SCHEMBL8966091 0.81 ESR1 (0.57) ESR1ESR2PTPN1TUBB4ATUBB
SCHEMBL7530105 0.80 PTPN1 (0.41) ESR1ESR2PTPN1TUBB4ATUBB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0832881-B1 Benzofluorene compounds, intermediates, compositions, and methods LILLY CO ELI (US) 2002-04-03 EP disclosed
EP-0832881-A2 Benzofluorene compounds, intermediates, compositions, and methods ELI LILLY AND COMPANY (US) 1998-04-01 EP disclosed