SCHEMBL5229047

SCHEMBL5229047

CCc1nn(CCO)c(CC)c1Oc1cc(C)cc(C)c1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.36
PGR P06401 1/20 0.33
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
KMT2A Q03164 1/20 0.31
PTGDR2 Q9Y5Y4 1/20 0.31
ATM Q13315 1/20 0.30

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
SCHEMBL2717137 0.88 KCNH2 (0.53) KCNH2PGRLMNAPTGDR2
SCHEMBL509302 0.85 PTGDR2 (0.38) KCNH2PGRMAPTPTGDR2
SCHEMBL5229393 0.85 OPRL1 (0.34) PGR
SCHEMBL4112540 0.83 PGR (0.38) KCNH2PGRLMNAMAPTSMN1; SMN2
Lersivirine SCHEMBL508446 0.82 KCNH2 (0.49) KCNH2PGRLMNAPTGDR2
SCHEMBL5230979 0.80 KCNH2 (0.36) KCNH2PGRPTGDR2
SCHEMBL5224650 0.80 PGR (0.39) PGRLMNAMAPTSMN1; SMN2KMT2A
SCHEMBL5227964 0.80 PTGDR2 (0.42) PGRLMNAMAPTHTTSMN1; SMN2
SCHEMBL5228272 0.80 PTGDR2 (0.36) KCNH2PGRKMT2APTGDR2
SCHEMBL508393 0.79 KCNH2 (0.44) KCNH2PGRLMNAKMT2A

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 KCNH2 3503/4885PGR 1045/4885LMNA 3857/4885

“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.