SCHEMBL1195233

SCHEMBL1195233

CCc1c(CC(=O)O)cnn1-c1ccc(F)cc1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NR4A3 Q92570 1/20 0.49
MAPT P10636 2/20 0.45
RAB9A P51151 2/20 0.45
P2RX7 Q99572 4/20 0.44
MAPK14 Q16539 2/20 0.41
KDM5A P29375 1/20 0.41
KDM4C Q9H3R0 1/20 0.41
KDM5B Q9UGL1 1/20 0.41
ALDH1A1 P00352 2/20 0.40
POLB P06746 1/20 0.40
SMO Q99835 2/20 0.40
MAPK1 P28482 1/20 0.39
NPC1 O15118 1/20 0.39
LMNA P02545 1/20 0.39
HPGD P15428 1/20 0.39
TSHR P16473 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HSD11B1 P28845 1/20 0.38

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
SCHEMBL1195290 0.83 P2RX7 (0.60) MAPTRAB9AP2RX7MAPK14ALDH1A1
SCHEMBL1195174 0.81 P2RX7 (0.59) MAPTRAB9AP2RX7MAPK14ALDH1A1
SCHEMBL1194321 0.78 P2RX7 (0.61) MAPTRAB9AP2RX7MAPK14ALDH1A1
SCHEMBL1195779 0.77 P2RX7 (0.77) P2RX7
SCHEMBL1194576 0.77 P2RX7 (0.41) MAPTRAB9AP2RX7MAPK14SMO
SCHEMBL13140239 0.74 P2RX7 (0.53) MAPTRAB9AP2RX7ALDH1A1SMO
SCHEMBL12338161 0.74 NR4A3 (0.66) NR4A3MAPTRAB9AALDH1A1SMO
SCHEMBL15790648 0.73 KDM4E (0.46) NR4A3MAPTRAB9AMAPK14ALDH1A1
SCHEMBL4499357 0.72 NR4A3 (0.59) NR4A3MAPTRAB9AMAPK14ALDH1A1
SCHEMBL17922506 0.71 P2RX7 (0.54) MAPTRAB9AP2RX7ALDH1A1POLB

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
EP-2155685-B1 PYRAZOLE DERIVATIVES AS P2X7 MODULATORS GLAXO GROUP LTD (GB) 2011-03-16 EP disclosed
US-20110046137-A1 Pyrazole Derivatives as P2X7 Modulators GLAXO GROUP LIMITED 2011-02-24 US disclosed
EP-2155685-A1 PYRAZOLE DERIVATIVES AS P2X7 MODULATORS Glaxo Group Limited (GB) 2010-02-24 EP disclosed
WO-2008138876-A1 PYRAZOLE DERIVATIVES AS P2X7 MODULATORS GLAXO GROUP LIMITED (GB) 2008-11-20 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-20110046137-A1 Pyrazole Derivatives as P2X7 Modulators P2RX3, P2RX7, P2RX1 NR4A3 561/4885MAPT 991/4885RAB9A 2601/4885

“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.