SCHEMBL324732

SCHEMBL324732

Cc1nc(N)c(S(=O)(=O)c2ccccc2)c(OC2CCNCC2)n1

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FFAR2 O15552 17/20 0.59
MAPT P10636 2/20 0.45
TP53 P04637 1/20 0.43

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
SCHEMBL324733 0.82 FFAR2 (0.46) FFAR2MAPT
SCHEMBL324104 0.78 FFAR2 (0.43) FFAR2MAPT
SCHEMBL17376531 0.74 FFAR2 (1.00) FFAR2
SCHEMBL18919264 0.74 FFAR2 (1.00) FFAR2
SCHEMBL18919260 0.71 FFAR2 (1.00) FFAR2
SCHEMBL17382200 0.68 FFAR2 (1.00) FFAR2
SCHEMBL324734 0.65 KDM4E (0.44) FFAR2
SCHEMBL15174484 0.64 RAPGEF4 (0.57) MAPT
SCHEMBL27876881 0.63 MAPT (0.47) FFAR2MAPTTP53
SCHEMBL4649415 0.63 ROCK1 (0.46)

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-8093246-B2 potent deoxycytidine kinase inhibitors; O-linked pyrimidin-4-amine-based compounds LEXICON PHARMACEUTICALS, INC. (US) 2012-01-10 US disclosed
US-20080146571-A1 O-LINKED PYRIMIDIN-4-AMINE-BASED COMPOUNDS, COMPOSITIONS COMPRISING THEM, AND METHODS OF THEIR USE TO TREAT CANCER OXFORD FINANCE LLC, AS COLLATERAL AGENT 2008-06-19 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-20080146571-A1 O-LINKED PYRIMIDIN-4-AMINE-BASED COMPOUNDS, COMPOSITIONS COMPRISING THEM, AND METHODS OF THEIR USE TO TREAT CANCER DPYD, DHFR, TYMP FFAR2 4433/4885MAPT 2750/4885TP53 35/4885

“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.