SCHEMBL3406312

SCHEMBL3406312

COC(=O)c1sc(Cl)nc1-c1nc(C)c(C)n1C

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
HPGD P15428 3/20 0.41
TSHR P16473 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.36
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
RAB9A P51151 2/20 0.36
POLB P06746 2/20 0.36
KDM4E B2RXH2 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MAPT P10636 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
LMNA P02545 1/20 0.35
NPC1 O15118 1/20 0.35

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
SCHEMBL3407038 0.83 ALDH1A1 (0.41) ALDH1A1L3MBTL1KDM4EHSD17B10MAPT
SCHEMBL509631 0.76 ADORA2A (0.37) ALDH1A1HPGDTSHRL3MBTL1KMT2A
SCHEMBL1552538 0.76 LMNA (0.36) ALDH1A1HPGDTSHRL3MBTL1KMT2A
SCHEMBL19981322 0.75 HPGD (0.63) ALDH1A1HPGDTSHRL3MBTL1KMT2A
SCHEMBL3406920 0.72 ALDH1A1 (0.43) ALDH1A1HPGDTSHRL3MBTL1KMT2A
SCHEMBL3399825 0.71 ALDH1A1 (0.40) ALDH1A1HPGDTSHRL3MBTL1KMT2A
SCHEMBL3405612 0.71 L3MBTL1 (0.43) ALDH1A1HPGDTSHRL3MBTL1KMT2A
SCHEMBL3402617 0.70 BRD4 (0.37) ALDH1A1KMT2AMEN1RAB9APOLB
SCHEMBL1724016 0.70 ALDH1A1 (0.46) ALDH1A1HPGDTSHRL3MBTL1KMT2A
SCHEMBL3400971 0.70 ALDH1A1 (0.45) ALDH1A1HPGDTSHRL3MBTL1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2158199-B1 PIPERIDINE COMPOUNDS AND USES THEREOF ASTRAZENECA AB (SE) 2010-11-17 EP disclosed
EP-2158199-B1 PIPERIDINE COMPOUNDS AND USES THEREOF ASTRAZENECA AB (SE) 2010-11-17 EP disclosed
WO-2008152418-A1 PIPERIDINE COMPOUNDS AND USES THEREOF ASTRAZENECA AB (SE) 2008-12-18 WO disclosed
US-20080312255-A1 PIPERDINE COMPOUNDS AND USES THEREOF-911 ASTRAZENECA AB (SE) 2008-12-18 US disclosed
US-20080312255-A1 PIPERDINE COMPOUNDS AND USES THEREOF-911 ASTRAZENECA AB (SE) 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-20080312255-A1 PIPERDINE COMPOUNDS AND USES THEREOF-911 NISCH, PIR, QDPR ALDH1A1 243/4885HPGD 394/4885TSHR 4161/4885

“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.