SCHEMBL5227746

SCHEMBL5227746

CCc1nn(CCO)c(CC)c1Oc1cc(Cl)ccc1Cl

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 4/20 0.42
CRHR1 P34998 1/20 0.37
MAPK8 P45983 1/20 0.35
FPR2 P25090 1/20 0.35
PROKR1 Q8TCW9 1/20 0.35
RHEB Q15382 2/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
HTR2A P28223 1/20 0.34
SLC6A4 P31645 1/20 0.34
KCNH2 Q12809 1/20 0.34
BRD4 O60885 1/20 0.34
BRD2 P25440 1/20 0.34
BRD3 Q15059 1/20 0.34
CREBBP Q92793 1/20 0.34
MARS1 P56192 1/20 0.34
S1PR4 O95977 1/20 0.33
GPBAR1 Q8TDU6 3/20 0.33
SPR P35270 1/20 0.32

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
SCHEMBL5226171 0.91 FPR2 (0.41) PTGDR2CRHR1MAPK8FPR2PROKR1
SCHEMBL6681697 0.87 PTGDR2 (0.39) PTGDR2CRHR1MAPK8RHEBALDH1A1
SCHEMBL5225185 0.85 LMNA (0.37) PTGDR2ALDH1A1LMNASLC6A4
SCHEMBL5224650 0.83 PGR (0.39) PTGDR2ALDH1A1LMNABRD4BRD2
SCHEMBL5228272 0.82 PTGDR2 (0.36) PTGDR2ALDH1A1HTR2ASLC6A4KCNH2
SCHEMBL5228227 0.81 PTGDR2 (0.40) PTGDR2RHEBLMNAHTR2ASLC6A4
SCHEMBL5225100 0.81 MAPK14 (0.37) PTGDR2ALDH1A1LMNAGPBAR1
SCHEMBL5229746 0.80 P2RX7 (0.37) PTGDR2CRHR1
SCHEMBL509302 0.80 PTGDR2 (0.38) PTGDR2CRHR1MAPK8ALDH1A1KCNH2
SCHEMBL5225352 0.79 AR (0.41) PTGDR2HTR2ASLC6A4KCNH2

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 PTGDR2 3728/4885CRHR1 3770/4885MAPK8 3815/4885

“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.