SCHEMBL2174718

SCHEMBL2174718

Cc1noc(C)c1-c1cccc2cc(S(=O)(=O)Cl)sc12

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 14/20 0.38
BRD2 P25440 9/20 0.38
BRD3 Q15059 6/20 0.38
FFAR1 O14842 1/20 0.37
CREBBP Q92793 2/20 0.37
NPC1 O15118 1/20 0.36
POLB P06746 1/20 0.36
CASP3 P42574 1/20 0.36
RAB9A P51151 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
CA2 P00918 2/20 0.36
ALDH1A1 P00352 1/20 0.36
KDM4E B2RXH2 1/20 0.34

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
SCHEMBL2175064 0.74 BRD4 (0.49) BRD4BRD2BRD3
SCHEMBL2176770 0.73 FBP1 (0.56)
SCHEMBL2176018 0.72 CA2 (0.46) CA2ALDH1A1
SCHEMBL2176153 0.71 BRD4 (0.44) BRD4BRD2CREBBPNPC1POLB
SCHEMBL2175480 0.68 HDAC3 (0.49) CA2ALDH1A1
SCHEMBL30718490 0.68 BRD4 (0.53) BRD4BRD2NPC1POLBCASP3
SCHEMBL2174657 0.67 CA2 (0.72) NPC1CA2ALDH1A1KDM4E
SCHEMBL2179388 0.67 BRD4 (0.43) BRD4BRD2BRD3CREBBPALDH1A1
SCHEMBL593750 0.67 DHFR (0.55) BRD4BRD2NPC1POLBCASP3
SCHEMBL17024283 0.64 BRD4 (0.44) BRD4BRD2BRD3CREBBPNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7973051-B2 Aminothiazoles as FBPase inhibitors for diabetes HOFFMAN-LA ROCHE INC. (US) 2011-07-05 US disclosed
EP-2227468-A1 AMINOTHIAZOLE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2010-09-15 EP disclosed
US-20090143448-A1 NEW AMINOTHIAZOLES AS FBPASE INHIBITORS FOR DIABETES F. HOFFMANN-LA ROCHE AG (CH) 2009-06-04 US disclosed
WO-2009068467-A1 AMINOTHIAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2009-06-04 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-20090143448-A1 NEW AMINOTHIAZOLES AS FBPASE INHIBITORS FOR DIABETES FBP1, SLC5A1, DPP4 BRD4 1000/4885BRD2 1144/4885BRD3 708/4885

“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.