SCHEMBL3400967

SCHEMBL3400967

COC(=O)c1sc(Cl)nc1-c1csc(N(C)C)n1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.38
NPC1 O15118 5/20 0.38
MAPT P10636 4/20 0.36
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
GRM1 Q13255 2/20 0.36
LMNA P02545 2/20 0.36
ALDH1A1 P00352 3/20 0.35
HPGD P15428 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
ADORA2A P29274 1/20 0.34
KDM4E B2RXH2 1/20 0.33
TSHR P16473 1/20 0.33
PIK3CD O00329 1/20 0.33
PIK3CA P42336 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33

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
SCHEMBL3406917 0.83 ALDH1A1 (0.46) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL3400971 0.81 ALDH1A1 (0.45) RAB9AMAPTMEN1KMT2ALMNA
SCHEMBL3405606 0.81 ECE1 (0.46) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL3406920 0.72 ALDH1A1 (0.43) RAB9ANPC1MAPTKMT2ALMNA
SCHEMBL13993307 0.71 ALDH1A1 (0.37) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL3402617 0.70 BRD4 (0.37) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL3402237 0.70 LMNA (0.44) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL11278098 0.70 LMNA (0.64) MEN1KMT2ALMNAALDH1A1RXFP1
SCHEMBL11289442 0.70 MAPT (0.52) RAB9ANPC1MAPTKMT2ALMNA
SCHEMBL3406697 0.69 ECE1 (0.44) MAPTMEN1KMT2ALMNAHPGD

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 RAB9A 399/4885NPC1 789/4885MAPT 2837/4885

“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.