SCHEMBL6310345

SCHEMBL6310345

CC(C)(C)OC(=O)NC1CCN(C(=O)c2cc3nccc(Cl)c3s2)C1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CFTR P13569 3/20 0.48
ADORA2A P29274 7/20 0.46
ADORA2B P29275 5/20 0.46
ADORA3 P0DMS8 2/20 0.46
PARP1 P09874 1/20 0.44
HDAC3 O15379 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC2 Q92769 1/20 0.42
KDM4D Q6B0I6 1/20 0.42
PDE10A Q9Y233 1/20 0.41
CYP2C9 P11712 1/20 0.41
HSD11B1 P28845 1/20 0.41
USP30 Q70CQ3 2/20 0.41
PADI4 Q9UM07 1/20 0.40
SIRT2 Q8IXJ6 1/20 0.40
SIRT1 Q96EB6 1/20 0.40
SIRT3 Q9NTG7 1/20 0.40
MET P08581 1/20 0.39
KDR P35968 1/20 0.39

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
SCHEMBL6302553 0.86 SIRT2 (0.40) CFTRADORA2AADORA2BADORA3KDM4D
SCHEMBL6302093 0.85 HRH4 (0.41) ADORA2BSIRT2SIRT1SIRT3MET
SCHEMBL6302516 0.80 POLB (0.52) CFTRSIRT2SIRT1SIRT3
SCHEMBL10223756 0.79 MAPT (0.52) ADORA2AADORA2BMETKDR
SCHEMBL4709933 0.79 KDR (0.43) ADORA2AADORA2BADORA3PARP1MET
SCHEMBL5240097 0.79 KDR (0.43) ADORA2AADORA2BADORA3PARP1MET
SCHEMBL4709934 0.79 KDR (0.43) ADORA2AADORA2BADORA3PARP1MET
SCHEMBL7002978 0.78 EGFR (0.45) CFTRADORA2AADORA2BADORA3PARP1
SCHEMBL8288013 0.78 PARP1 (0.48) CFTRADORA2AADORA2BADORA3PARP1
SCHEMBL6302589 0.78 HPGD (0.41) ADORA2AADORA2BADORA3METKDR

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 3 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
US-20020042409-A1 Thiophene derivatives useful as anticancer agents PFIZER PRODUCTS INC. 2002-04-11 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-20020042409-A1 Thiophene derivatives useful as anticancer agents TP53, RCC1, CCNA1 CFTR 264/4885ADORA2A 3116/4885ADORA2B 3870/4885

“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.