SCHEMBL5197863

SCHEMBL5197863

Cc1cccc(-c2nc(C(C)C)[nH]c2-c2cccc(-c3ccc(S(N)(=O)=O)cc3)c2)n1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA2 P00918 9/20 0.46
CA9 Q16790 8/20 0.46
CA12 O43570 7/20 0.46
LRRK2 Q5S007 5/20 0.42
KDM4E B2RXH2 1/20 0.41
CA1 P00915 8/20 0.40
TGFBR1 P36897 2/20 0.40
PTGS2 P35354 3/20 0.39
PTGS1 P23219 2/20 0.38
CA7 P43166 1/20 0.37

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
SCHEMBL5198218 0.84 LRRK2 (0.45) LRRK2KDM4ETGFBR1
SCHEMBL5226169 0.83 TGFBR1 (0.46) KDM4ETGFBR1
SCHEMBL5199968 0.82 TGFBR1 (0.46) KDM4ETGFBR1PTGS2PTGS1
SCHEMBL5199910 0.82 RXRA (0.46) KDM4ETGFBR1
SCHEMBL5200026 0.81 TGFBR1 (0.46) KDM4ETGFBR1PTGS2PTGS1
SCHEMBL5200092 0.80 TGFBR1 (0.46) KDM4ETGFBR1
SCHEMBL5199766 0.80 TGFBR1 (0.44) LRRK2KDM4ETGFBR1
SCHEMBL5197872 0.79 TGFBR1 (0.43) LRRK2TGFBR1PTGS2PTGS1
SCHEMBL5227673 0.79 TLR8 (0.50) KDM4ETGFBR1
SCHEMBL5199629 0.79 LRRK2 (0.42) CA2CA9CA12LRRK2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070275968-A1 Substituted Biphenyl Derivative SANKYO COMPANY, LIMITED (JP) 2007-11-29 US disclosed
EP-1798229-A1 SUBSTITUTED BIPHENYL DERIVATIVE Sankyo Company, Limited (JP) 2007-06-20 EP 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-20070275968-A1 Substituted Biphenyl Derivative COL2A1, COL1A1, FGFR3 CA2 236/4885CA9 1446/4885CA12 1900/4885

“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.