SCHEMBL4986052

SCHEMBL4986052

Nc1ncnc2c1CCN(S(=O)(=O)c1ccccc1Cl)C2

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 2/20 0.43
CTSG P08311 1/20 0.41
CMA1 P23946 1/20 0.41
HTR6 P50406 1/20 0.40
LIPE Q05469 1/20 0.39
FAAH O00519 2/20 0.39
TSHR P16473 2/20 0.38
HSD11B1 P28845 1/20 0.38
TRPC5 Q9UL62 1/20 0.38
MKNK1 Q9BUB5 2/20 0.38
KMT2A Q03164 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
GBA1 P04062 1/20 0.38
P2RX7 Q99572 1/20 0.38
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 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
SCHEMBL4986062 0.88 ALDH1A1 (0.52) TSHRKMT2AL3MBTL1
SCHEMBL4992341 0.86 MET (0.41) HTR6KMT2AP2RX7
SCHEMBL4985357 0.85 CTSG (0.41) CTSGCMA1TSHRMKNK1KMT2A
SCHEMBL4988082 0.85 KMT2A (0.55) MKNK1KMT2AL3MBTL1
SCHEMBL4991405 0.85 MKNK1 (0.45) HSD11B1TRPC5MKNK1P2RX7
SCHEMBL4991988 0.83 ALOX5AP (0.43)
SCHEMBL4992139 0.83 KDM4E (0.47) TSHRKMT2AL3MBTL1GBA1
SCHEMBL4985240 0.82 TRPV4 (0.45) CYP3A4
SCHEMBL4988605 0.82 ALDH1A1 (0.55) TSHRHSD11B1KMT2AL3MBTL1
SCHEMBL4989331 0.82 MKNK1 (0.43) TSHRMKNK1KMT2AL3MBTL1

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-20080039478-A1 Bicycloheteroaryl Compounds as P2X7 Modulators and Uses Thereof RENOVIS, INC. 2008-02-14 US claimed
US-7297700-B2 Bicycloheteroaryl compounds as P2X7 modulators and uses thereof RENOVIS, INC. (US) 2007-11-20 US claimed

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-20080039478-A1 Bicycloheteroaryl Compounds as P2X7 Modulators and Uses Thereof P2RX7, P2RX3, P2RX2 CHRM4 445/4885CTSG 532/4885CMA1 3549/4885

“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.