SCHEMBL13856448

SCHEMBL13856448

O=C(CSc1n[nH]c(-c2ccccc2)n1)c1ccc(O)c(O)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALPL P05186 8/20 1.00
ALPG P10696 7/20 1.00
HPGD P15428 4/20 1.00
SMN1; SMN2 Q16637 3/20 1.00
LMNA P02545 3/20 1.00
MAPT P10636 3/20 1.00
POLB P06746 2/20 1.00
ALPI P09923 2/20 1.00
GAA P10253 2/20 1.00
KDM4E B2RXH2 1/20 1.00
HSP90AA1 P07900 1/20 1.00
HSP90AB1 P08238 1/20 1.00
ALOX15 P16050 1/20 1.00
ALOX12 P18054 1/20 1.00
NR4A1 P22736 1/20 1.00
RECQL P46063 1/20 1.00
GCGR P47871 1/20 1.00
NPSR1 Q6W5P4 1/20 1.00
ESR2 Q92731 1/20 1.00
L3MBTL1 Q9Y468 1/20 1.00

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
SCHEMBL1528416 0.82 ALPL (1.00) ALPLALPGHPGDSMN1; SMN2LMNA
SCHEMBL23527284 0.77 ALPG (0.63) ALPLALPGHPGDSMN1; SMN2LMNA
SCHEMBL18805093 0.74 ALPG (0.65) ALPLALPGHPGDSMN1; SMN2LMNA
SCHEMBL13856739 0.73 POLB (0.64) ALPLALPGHPGDSMN1; SMN2LMNA
SCHEMBL31270594 0.71 ALPG (1.00) ALPLALPGHPGDSMN1; SMN2LMNA
SCHEMBL23196643 0.71 ALPG (0.61) ALPLALPGHPGDSMN1; SMN2LMNA
SCHEMBL1770377 0.71 PTGES (0.64) ALPLALPGHPGDSMN1; SMN2LMNA
SCHEMBL14385406 0.71 ALPG (0.55) ALPLALPGHPGDSMN1; SMN2LMNA
SCHEMBL14895771 0.69 GRK6 (0.73) GRK6
SCHEMBL11511782 0.69 DCUN1D1 (0.67) ALPLHPGDSMN1; SMN2MEN1KMT2A

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 ALPL 4201/4885ALPG 353/4885HPGD 2147/4885

“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.