SCHEMBL5229746

SCHEMBL5229746

CCc1nn(CCO)c(CC)c1Oc1c(Cl)cccc1Cl

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.37
ESR1 P03372 2/20 0.36
SLC22A12 Q96S37 7/20 0.35
MAPK14 Q16539 1/20 0.35
ATM Q13315 1/20 0.35
PTGDR2 Q9Y5Y4 5/20 0.34
RARG P13631 1/20 0.33
RORC P51449 1/20 0.33
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CRHR1 P34998 1/20 0.31

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
SCHEMBL5225100 0.88 MAPK14 (0.37) P2RX7ESR1SLC22A12MAPK14ATM
SCHEMBL5225185 0.87 LMNA (0.37) P2RX7ESR1SLC22A12MAPK14ATM
SCHEMBL5226203 0.84 DHODH (0.38) ATMPTGDR2RARGRORC
SCHEMBL5228227 0.83 PTGDR2 (0.40) PTGDR2KMT2A
SCHEMBL5224650 0.82 PGR (0.39) PTGDR2KMT2A
SCHEMBL5228272 0.81 PTGDR2 (0.36) PTGDR2MEN1KMT2A
SCHEMBL5227746 0.80 PTGDR2 (0.42) PTGDR2CRHR1
SCHEMBL5226171 0.80 FPR2 (0.41) PTGDR2CRHR1
SCHEMBL509302 0.79 PTGDR2 (0.38) PTGDR2CRHR1
SCHEMBL5228213 0.78 KDM4E (0.36) P2RX7ATMPTGDR2RARGRORC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1377556-B1 PYRAZOLE DERIVATIVES FOR TREATING HIV PFIZER LTD (GB) 2007-04-04 EP claimed
EP-1762567-A1 Pyrazole derivatives for treating HIV Pfizer Limited (GB) 2007-03-14 EP claimed
EP-1377556-A1 PYRAZOLE DERIVATIVES FOR TREATING HIV Pfizer Limited (GB) 2004-01-07 EP claimed
US-20030100554-A1 Pyrazole derivatives JONES LYN HOWARD (GB) 2003-05-29 US claimed
WO-2002085860-A1 PYRAZOLE DERIVATIVES FOR TREATING HIV PFIZER LIMITED (GB) 2002-10-31 WO 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-20030100554-A1 Pyrazole derivatives REV1, SARS1, CYP2F1 P2RX7 2065/4885ESR1 3690/4885SLC22A12 4593/4885

“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.