SCHEMBL2718384

SCHEMBL2718384

CC(=O)OC(C)C#Cc1cc(F)ccc1/C=N/O

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ MPO P05164 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
SCHEMBL2718388 1.00 POLB (0.32) POLBMAPTRAB9AALDH1A1LMNA
SCHEMBL2719916 0.86 ERN1 (0.32) MAPTALDH1A1MPO
SCHEMBL15445445 0.82 USP2 (0.36) MAPTALDH1A1LMNAL3MBTL1
SCHEMBL2717538 0.82 USP2 (0.36) MAPTALDH1A1LMNAL3MBTL1
SCHEMBL2717541 0.82 USP2 (0.36) MAPTALDH1A1LMNAL3MBTL1
SCHEMBL4090157 0.76 ALDH1A1 (0.35) POLBMAPTRAB9AALDH1A1LMNA
SCHEMBL2717906 0.67 MEN1 (0.34) ALDH1A1LMNA
SCHEMBL17539208 0.62 HPGD (0.43) POLBMAPTRAB9AALDH1A1LMNA
SCHEMBL17503146 0.62 HPGD (0.43) POLBMAPTRAB9AALDH1A1LMNA
SCHEMBL17503145 0.62 HPGD (0.43) POLBMAPTRAB9AALDH1A1LMNA

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-20140031355-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2014-01-30 — — US disclosed
EP-2635565-A1 5 -CYANO-4, 6 -DIAMINOPYRIMIDINE OR 6 -AMINOPURINE DERIVATIVES AS PI3K- DELTA INHIBITORS Amgen Inc. (US) 2013-09-11 — — EP disclosed
WO-2012061696-A1 5 -CYANO-4, 6 -DIAMINOPYRIMIDINE OR 6 -AMINOPURINE DERIVATIVES AS PI3K- DELTA INHIBITORS AMGEN INC. (US) 2012-05-10 — — 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-20140031355-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES MCL1, SSB, MALT1 POLB 3908/4885MAPT 2133/4885RAB9A 4201/4885

“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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