SCHEMBL1693155

SCHEMBL1693155

O=Cc1ccc2c(c1)c(Br)nn2Cc1ccc(Cl)cc1C(F)(F)F

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ESRRA P11474 17/20 0.49
▸ PTGER4 P35408 1/20 0.44
▸ GPR183 P32249 1/20 0.43
▸ NR1H2 P55055 1/20 0.37
▸ NR1H3 Q13133 1/20 0.37
▸ KCNH2 Q12809 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
SCHEMBL1693295 0.89 ESRRA (0.51) ESRRAPTGER4GPR183NR1H2NR1H3
SCHEMBL1693521 0.88 ESRRA (0.52) ESRRAPTGER4GPR183NR1H2NR1H3
SCHEMBL1693168 0.87 ESRRA (0.53) ESRRAPTGER4GPR183KCNH2
SCHEMBL1692611 0.87 ESRRA (0.62) ESRRAPTGER4GPR183NR1H2NR1H3
SCHEMBL1692784 0.87 ESRRA (0.51) ESRRAPTGER4GPR183
SCHEMBL1693439 0.85 ESRRA (0.47) ESRRAPTGER4GPR183NR1H2NR1H3
SCHEMBL1692622 0.85 ESRRA (0.49) ESRRAPTGER4GPR183NR1H2NR1H3
SCHEMBL1692605 0.83 ESRRA (0.48) ESRRAPTGER4GPR183NR1H2NR1H3
SCHEMBL1693414 0.83 ESRRA (0.46) ESRRAPTGER4GPR183NR1H2NR1H3
SCHEMBL12067309 0.81 ESRRA (0.66) ESRRAKCNH2

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
US-8796256-B2 Substituted thiazolidinedione indazoles, indoles and benzotriazoles as estrogen-related receptor-α modulators JANSSEN PHARMACEUTICA NV (BE) 2014-08-05 — — US disclosed
WO-2011149841-A1 SUBSTITUTED THIAZOLIDINEDIONE INDAZOLES, INDOLES AND BENZOTRIAZOLES AS ESTROGEN-RELATED RECEPTOR-α MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2011-12-01 — — WO disclosed
US-20110294780-A1 SUBSTITUTED THIAZOLIDINEDIONE INDAZOLES, INDOLES AND BENZOTRIAZOLES AS ESTROGEN-RELATED RECEPTOR-a MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2011-12-01 — — 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-20110294780-A1 SUBSTITUTED THIAZOLIDINEDIONE INDAZOLES, INDOLES AND BENZOTRIAZOLES AS ESTROGEN-RELATED RECEPTOR-a MODULATORS ESR2, IGF1R, ESRRA ESRRA 3/4885PTGER4 548/4885GPR183 432/4885

“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.

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