SCHEMBL7107480

SCHEMBL7107480

COc1ccc(C(=O)C2=C(c3cccc(Cl)c3)CCc3cc(OC)ccc32)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.46
ESR2 Q92731 2/20 0.46
HPGD P15428 1/20 0.43
MAPT P10636 7/20 0.43
RAB9A P51151 3/20 0.43
SLC6A3 Q01959 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
TP53 P04637 3/20 0.42
SLC6A2 P23975 1/20 0.41
GRM5 P41594 1/20 0.41
GRIN2C Q14957 1/20 0.41
NPC1 O15118 2/20 0.41
TAS2R14 Q9NYV8 1/20 0.41
NFKB1 P19838 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
LMNA P02545 1/20 0.40
HSP90AA1 P07900 1/20 0.39
HSP90AB1 P08238 1/20 0.39
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL7111266 0.91 ESR1 (0.47) ESR1ESR2MAPTRAB9ASMN1; SMN2
SCHEMBL7109898 0.90 ESR1 (0.51) ESR1ESR2MAPTSLC6A3SMN1; SMN2
SCHEMBL3976908 0.88 ESR1 (0.55) ESR1ESR2MAPTRAB9ASMN1; SMN2
SCHEMBL3862097 0.86 ESR1 (0.52) ESR1ESR2HPGDMAPTRAB9A
SCHEMBL7108932 0.86 ESR1 (0.52) ESR1ESR2MAPTRAB9ASMN1; SMN2
SCHEMBL7106199 0.83 ESR1 (0.44) ESR1ESR2HPGDMAPTRAB9A
SCHEMBL7110390 0.82 ALDH1A1 (0.51) ESR1ESR2HPGDMAPTRAB9A
SCHEMBL3861662 0.82 ESR1 (0.60) ESR1ESR2HPGDMAPTRAB9A
SCHEMBL6135986 0.82 ESR1 (0.58) ESR1ESR2MAPTRAB9ASMN1; SMN2
SCHEMBL7106880 0.81 ESR1 (0.51) ESR1ESR2MAPTRAB9ASMN1; SMN2

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
US-20030100754-A1 NAPHTHALENE COMPOUNDS, INTERMEDIATES, FORMULATIONS, AND METHODS ELI LILLY AND COMPANY 2003-05-29 US disclosed
US-5958916-A FOR INHIBITING BONE LOSS OR BONE RESORPTION ELI LILLY AND COMPANY (US) 1999-09-28 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030100754-A1 NAPHTHALENE COMPOUNDS, INTERMEDIATES, FORMULATIONS, AND METHODS NDC1, SQLE, NQO1 ESR1 1044/4885ESR2 2130/4885HPGD 116/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.