SCHEMBL209212

SCHEMBL209212

CCCCCCCCn1nc(-c2ccccc2O)cc1C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 1/20 0.45
▸ SMPD1 P17405 1/20 0.45
▸ CA12 O43570 1/20 0.42
▸ CA1 P00915 1/20 0.42
▸ CA2 P00918 1/20 0.42
▸ CA9 Q16790 1/20 0.42

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
SCHEMBL27811117 0.75 CA12 (0.65) CA12CA1CA2CA9
SCHEMBL27811234 0.75 MAPT (0.44) CA12CA1CA2CA9
SCHEMBL250115 0.75 LMNA (0.40) CA12CA1CA2CA9
SCHEMBL596066 0.74 SMN1; SMN2 (0.53) —
SCHEMBL4754841 0.74 KDM4E (0.50) SMPD1
SCHEMBL27699443 0.71 CNR1 (0.54) SMPD1
SCHEMBL1739252 0.71 ALPL (0.46) CA12CA1CA2CA9
SCHEMBL28820586 0.70 CNR1 (0.71) —
SCHEMBL3614239 0.69 KDM4E (0.51) —
SCHEMBL3434182 0.69 ALDH1A1 (0.48) CA12CA1CA2CA9

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140264166-A1 PHENOXYPYRAZOLE COMPOSITION AND PROCESS FOR THE SOLVENT EXTRACTION OF METALS CYTEC TECHNOLOGY CORP. (US) 2014-09-18 — — US disclosed
US-20130264519-A1 Phenoxypyrazole Composition and Process for the Solvent Extraction of Metals CYTEC TECHNOLOGY CORP. 2013-10-10 — — US disclosed
US-8470052-B2 Phenoxypyrazole composition and process for the solvent extraction of metals CYTEC TECHNOLOGY CORP. (US) 2013-06-25 — — US disclosed
EP-1926713-B1 PROCESS FOR THE SOLVENT EXTRACTION OF METALS CYTEC TECH CORP (US) 2013-04-10 — — EP disclosed
US-20120118109-A1 PHENOXYPYRAZOLE COMPOSITION AND PROCESS FOR THE SOLVENT EXTRACTION OF METALS CYTEC TECHNOLOGY CORP. (US) 2012-05-17 — — US disclosed
US-8088810-B2 Phenoxypyrazole composition and process for the solvent extraction of metals CYTEC TECHNOLOGY CORP. (US) 2012-01-03 — — US disclosed
US-20080312452-A1 Phenoxypyrazole Composition and Process for the Solvent Extraction of Metals CYTEC TECHNOLOGY CORP. 2008-12-18 — — 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-20080312452-A1 Phenoxypyrazole Composition and Process for the Solvent Extraction of Metals PRMT9, CHD9, CYP2C9 TLR8 1989/4885SMPD1 4868/4885CA12 1372/4885

“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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