SCHEMBL4816490

SCHEMBL4816490

Cc1cc2c(cc1CO)C1(CC2)OCCO1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
SLC5A1 P13866 1/20 0.31
SLC5A2 P31639 1/20 0.31
SHBG P04278 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
SCHEMBL4814771 0.79 ESR1 (0.33) ESR1ESR2
SCHEMBL14499144 0.78 RXRA (0.41) ESR1ESR2SHBG
SCHEMBL4814705 0.76 BCHE (0.33)
SCHEMBL4810769 0.73 PDK2 (0.33) ESR1ESR2
SCHEMBL4816590 0.73 PDCD1 (0.33)
SCHEMBL4815280 0.72 ESR2 (0.37) ESR1ESR2
SCHEMBL4818120 0.70
SCHEMBL4818565 0.67 KDM4E (0.36) ESR1ESR2
SCHEMBL16281782 0.65 SHBG (0.39) SHBG
SCHEMBL15137356 0.64 SHBG (0.38) SHBG

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-1740579-B1 TRICYCLIC PYRAZOLE KINASE INHIBITORS ABBVIE INC (US) 2015-08-19 EP disclosed
US-7468371-B2 Tricyclic pyrazole kinase inhibitors ABBOTT LABORATORIES INC. (US) 2008-12-23 US disclosed
US-20060014816-A1 Tricyclic pyrazole kinase inhibitors ABBVIE INC. 2006-01-19 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-20060014816-A1 Tricyclic pyrazole kinase inhibitors PRKDC, PRKACA, PIK3C3 ESR1 3300/4885ESR2 2618/4885SLC5A1 4234/4885

“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.