SCHEMBL4983025

SCHEMBL4983025

Nc1ncnc2c1CCN(S(=O)(=O)c1ccc(F)cc1)C2

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
PKM P14618 4/20 0.47
KDM4E B2RXH2 2/20 0.44
LMNA P02545 3/20 0.43
ALDH1A1 P00352 2/20 0.42
HPGD P15428 1/20 0.42
PIK3R1 P27986 2/20 0.42
PIK3CA P42336 2/20 0.42
PIK3CD O00329 1/20 0.42
PIK3CG P48736 1/20 0.42
THRB P10828 1/20 0.41
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
HSD11B1 P28845 1/20 0.40
TSHR P16473 1/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
MKNK1 Q9BUB5 2/20 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
SCHEMBL4988452 0.88 MEN1 (0.51) MEN1KMT2APKMALDH1A1GAA
SCHEMBL4988330 0.88 CD4 (0.50) PKMALDH1A1GAAHSD11B1HTT
SCHEMBL4993378 0.88 KMT2A (0.49) MEN1KMT2APKMLMNAMAPT
SCHEMBL4987934 0.87 HSD11B1 (0.45) MEN1KMT2AKDM4EALDH1A1GAA
SCHEMBL4987016 0.84 PKM (0.51) PKMKDM4ELMNAALDH1A1HSD11B1
SCHEMBL4988783 0.84 GAA (0.49) MEN1KMT2APKMKDM4EGAA
SCHEMBL4985230 0.84 MEN1 (0.43) MEN1KMT2A
SCHEMBL4982847 0.84 LMNA (0.41) MEN1KMT2APKMLMNAALDH1A1
SCHEMBL4992568 0.84 MEN1 (0.46) MEN1KMT2APKMALDH1A1THRB
SCHEMBL4980965 0.83 SMN1; SMN2 (0.49) MEN1KMT2ALMNAALDH1A1MAPT

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 MEN1 4853/4885KMT2A 4614/4885PKM 1098/4885

“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.