SCHEMBL6282610

SCHEMBL6282610

Oc1ccc2c(c1)C=C(c1ccccc1)C21Cc2ccccc2C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 13/20 1.00
ESR1 P03372 12/20 1.00
ALOX5 P09917 1/20 0.36
MMP3 P08254 1/20 0.33
BCL2L1 Q07817 1/20 0.33
DRD2 P14416 1/20 0.33
DRD1 P21728 1/20 0.33

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
SCHEMBL6286186 0.94 ESR1 (1.00) ESR2ESR1MMP3BCL2L1
SCHEMBL6286195 0.91 ESR1 (1.00) ESR2ESR1
SCHEMBL6283895 0.88 ESR2 (1.00) ESR2ESR1ALOX5
SCHEMBL6286158 0.82 ESR1 (0.75) ESR2ESR1
SCHEMBL6283932 0.81 ESR1 (1.00) ESR2ESR1
SCHEMBL22568966 0.66 ESR2 (0.49) ESR2ESR1ALOX5MMP3BCL2L1
SCHEMBL6794599 0.65 ESR2 (0.49) ESR2ESR1DRD2DRD1
SCHEMBL6282618 0.64 ESR2 (1.00) ESR2ESR1
SCHEMBL22568910 0.64 ESR1 (0.47) ESR2ESR1ALOX5DRD2DRD1
SCHEMBL12009549 0.63 ESR1 (0.52) ESR2ESR1MMP3BCL2L1

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-6838584-B2 Estrogen receptor modulators MERCK & CO., INC. (US) 2005-01-04 US disclosed
US-20040162304-A1 Estrogen receptor modulators MERCK & CO., INC. 2004-08-19 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-20040162304-A1 Estrogen receptor modulators ESRRA, GPER1, ESRRB ESR2 4/4885ESR1 5/4885ALOX5 788/4885

“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.