SCHEMBL13856524

SCHEMBL13856524

C=CCn1c(SCC(=O)c2ccc(O)c(O)c2)nnc1-c1ccccc1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALPG P10696 14/20 1.00
▸ ALPL P05186 7/20 1.00
▸ KDM4E B2RXH2 4/20 1.00
▸ POLB P06746 4/20 1.00
▸ GAA P10253 4/20 1.00
▸ RECQL P46063 3/20 1.00
▸ MAPT P10636 3/20 1.00
▸ ALOX15 P16050 2/20 1.00
▸ L3MBTL1 Q9Y468 7/20 0.80
▸ TSHR P16473 4/20 0.80
▸ LMNA P02545 3/20 0.80
▸ NSD2 O96028 2/20 0.80
▸ APEX1 P27695 2/20 0.80
▸ MCL1 Q07820 2/20 0.80
▸ HSD17B10 Q99714 2/20 0.80
▸ ALOX12 P18054 2/20 0.80
▸ HTT P42858 1/20 0.80
▸ ESR2 Q92731 1/20 0.80
▸ TDP1 Q9NUW8 1/20 0.71
▸ CDC25A P30304 2/20 0.64

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
SCHEMBL29683780 1.00 ALPG (1.00) ALPGALPLKDM4EPOLBGAA
SCHEMBL18556559 0.78 ALPG (1.00) ALPGALPLKDM4EPOLBGAA
SCHEMBL4218138 0.76 TSHR (0.77) ALPGALPLKDM4EPOLBGAA
SCHEMBL4208435 0.73 PTGES (0.85) ALPGALPLKDM4EPOLBGAA
SCHEMBL4143469 0.71 ALPG (1.00) ALPGALPLKDM4EPOLBGAA
SCHEMBL4211375 0.70 ALPG (0.78) ALPGALPLKDM4EPOLBGAA
SCHEMBL1528416 0.69 ALPL (1.00) ALPGALPLKDM4EPOLBGAA
SCHEMBL4215585 0.69 ALDH1A1 (0.79) ALPGKDM4EPOLBGAARECQL
SCHEMBL28820656 0.69 GAA (0.58) ALPGALPLKDM4EPOLBGAA
SCHEMBL4210901 0.69 ALDH1A1 (0.67) ALPGKDM4EPOLBGAARECQL

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-20090118135-A1 METHODS AND COMPOUNDS FOR REGULATING APOPTOSIS THE BURNHAM INSTITUTE (US) 2009-05-07 — — US disclosed
US-20090118135-A1 METHODS AND COMPOUNDS FOR REGULATING APOPTOSIS THE BURNHAM INSTITUTE (US) 2009-05-07 — — 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-20090118135-A1 METHODS AND COMPOUNDS FOR REGULATING APOPTOSIS BCL2, BAX, BAD ALPG 353/4885ALPL 4201/4885KDM4E 3373/4885

“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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