SCHEMBL14918908

SCHEMBL14918908

CC(C)Oc1cc(B2OC(C)(C)C(C)(C)O2)cc(C(C)(C)C)c1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NR1I2 O75469 1/20 0.37
HIF1A Q16665 1/20 0.36
LPL P06858 5/20 0.33
LIPG Q9Y5X9 5/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
AAK1 Q2M2I8 2/20 0.33
FFAR1 O14842 1/20 0.31

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
SCHEMBL21117344 0.84 HIF1A (0.39) NR1I2HIF1ALPLLIPGCA1
SCHEMBL13268591 0.83 NR1I2 (0.42) NR1I2HIF1ALPLLIPGCA1
SCHEMBL17350120 0.81 LPL (0.41) NR1I2HIF1ALPLLIPGCA1
SCHEMBL12205425 0.81 LPL (0.41) NR1I2HIF1ALPLLIPGCA1
SCHEMBL9987187 0.79 AAK1 (0.33) LPLLIPGCA1CA2CA9
SCHEMBL23712499 0.79 CA1 (0.38) LPLLIPGCA1CA2CA9
SCHEMBL30345334 0.79 CA1 (0.38) LPLLIPGCA1CA2CA9
SCHEMBL20357964 0.74 LPL (0.37) NR1I2HIF1ALPLLIPGCA1
SCHEMBL23909384 0.74 LPL (0.41) NR1I2HIF1ALPLLIPGFFAR1
SCHEMBL29416738 0.74 LPL (0.41) NR1I2HIF1ALPLLIPGFFAR1

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-20140275049-A1 SUBSTITUTED PYRAZOLE ANALOGS As RAR ANTAGONISTS ELI LILLY AND COMPANY 2014-09-18 US disclosed
WO-2013066640-A1 SUBSTITUTED PYRAZOLE ANALOGUES AS RAR ANTAGONISTS ELI LILLY AND COMPANY (US) 2013-05-10 WO 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-20140275049-A1 SUBSTITUTED PYRAZOLE ANALOGS As RAR ANTAGONISTS RARB, RARA, RARG NR1I2 13/4885HIF1A 1804/4885LPL 4248/4885

“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.