SCHEMBL4921842

SCHEMBL4921842

CCCN1CC(OC)=CC1=O

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ CA1 P00915 1/20 0.33
▸ CA9 Q16790 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ LMNA P02545 1/20 0.31
▸ PARP1 P09874 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ PARP2 Q9UGN5 1/20 0.31
▸ FSHR P23945 1/20 0.31
▸ TP53 P04637 1/20 0.30
▸ MEN1 O00255 2/20 0.30
▸ KMT2A Q03164 2/20 0.30
▸ DRD2 P14416 1/20 0.30
▸ NPC1 O15118 1/20 0.30
▸ RECQL P46063 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
SCHEMBL2657547 0.85 CA1 (0.35) ALDH1A1CA1CA9LMNA
SCHEMBL21341572 0.79 CA1 (0.34) CA1CA9
SCHEMBL9302170 0.75 LMNA (0.36) ALDH1A1KDM4ECA1CA9LMNA
SCHEMBL4921010 0.66 HSD17B10 (0.44) ALDH1A1KDM4ETSHRTP53NPC1
SCHEMBL2659162 0.65 CA1 (0.35) CA1CA9
SCHEMBL4325663 0.64 CA1 (0.38) CA1CA9LMNA
SCHEMBL21341851 0.64 CA1 (0.34) CA1CA9
SCHEMBL2660305 0.64 CA1 (0.34) KDM4ETSHRCA1CA9
SCHEMBL10718524 0.64 L3MBTL1 (0.42) ALDH1A1L3MBTL1LMNAPARP1HTT
SCHEMBL12706420 0.63 POLB (0.36) L3MBTL1MEN1KMT2ANPC1RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080318943-A1 Compounds and Uses Thereof - 848 ASTRAZENECA AB (SE) 2008-12-25 — — 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-20080318943-A1 Compounds and Uses Thereof - 848 COMT, BACE1, BDNF ALDH1A1 442/4885KDM4E 2357/4885TSHR 265/4885

“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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