SCHEMBL6302553

SCHEMBL6302553

CC(C)(C)OC(=O)NC1C2CN(C(=O)c3cc4nccc(Cl)c4s3)CC21

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 2/20 0.40
SIRT1 Q96EB6 2/20 0.40
SIRT3 Q9NTG7 2/20 0.40
CFTR P13569 2/20 0.38
ANO1 Q5XXA6 1/20 0.37
KDM4D Q6B0I6 1/20 0.35
MKNK1 Q9BUB5 4/20 0.35
ADORA2A P29274 5/20 0.34
ADORA2B P29275 4/20 0.34
KDR P35968 3/20 0.34
MET P08581 2/20 0.34
RORC P51449 2/20 0.34
ADORA3 P0DMS8 2/20 0.34
ADORA1 P30542 1/20 0.34
FLT1 P17948 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
SCHEMBL6310345 0.86 CFTR (0.48) SIRT2SIRT1SIRT3CFTRKDM4D
SCHEMBL6302516 0.80 POLB (0.52) SIRT2SIRT1SIRT3CFTR
SCHEMBL6305048 0.79 SIRT3 (0.38) SIRT2SIRT1SIRT3KDRMET
SCHEMBL10224379 0.79 MAPT (0.45) SIRT2SIRT1SIRT3KDRMET
SCHEMBL6302426 0.79 KDR (0.39) SIRT2SIRT1SIRT3KDRMET
SCHEMBL5837898 0.78 MAPT (0.39) SIRT2SIRT1SIRT3KDRMET
SCHEMBL5240306 0.78 PDE4A (0.40) SIRT2SIRT1SIRT3ADORA2AADORA2B
SCHEMBL4709508 0.78 MAPT (0.39) SIRT2SIRT1SIRT3KDRMET
SCHEMBL6302021 0.78 MAPT (0.39) SIRT2SIRT1SIRT3KDRMET
SCHEMBL5837893 0.78 MAPT (0.39) SIRT2SIRT1SIRT3KDRMET

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
US-6964961-B2 Thiophene derivatives useful as anticancer agents PFIZER INC (US) 2005-11-15 US disclosed
EP-1287001-B1 THIOPHENE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER PROD INC (US) 2004-09-29 EP disclosed
EP-1287001-A1 THIOPHENE DERIVATIVES USEFUL AS ANTICANCER AGENTS Pfizer Products Inc. (US) 2003-03-05 EP disclosed
US-20020042409-A1 Thiophene derivatives useful as anticancer agents PFIZER PRODUCTS INC. 2002-04-11 US disclosed
WO-2001094353-A1 THIOPHENE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER PRODUCTS INC. (US) 2001-12-13 WO 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-20020042409-A1 Thiophene derivatives useful as anticancer agents TP53, RCC1, CCNA1 SIRT2 1943/4885SIRT1 1929/4885SIRT3 2531/4885

“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.