SCHEMBL5227112

SCHEMBL5227112

Cc1n[nH]c(CC(=O)NCc2ccccc2C(F)(F)F)c1Oc1cc(Cl)cc(Cl)c1

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 18/20 0.53
DGAT2 Q96PD7 1/20 0.42
P2RX4 Q99571 1/20 0.41

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
SCHEMBL5227908 0.83 P2RX7 (0.58) P2RX7DGAT2
SCHEMBL5226230 0.82 P2RX7 (0.62) P2RX7
SCHEMBL5229533 0.80 P2RX7 (0.50) P2RX7
SCHEMBL5227699 0.80 P2RX7 (0.62) P2RX7
SCHEMBL5224612 0.78 KCNH2 (0.47) P2RX7
SCHEMBL508731 0.74 P2RX7 (0.41) P2RX7
SCHEMBL10254128 0.74 P2RX7 (0.41) P2RX7
SCHEMBL5227612 0.73 CYP3A4 (0.48)
SCHEMBL5225140 0.72 KMT2A (0.47)
SCHEMBL5619683 0.71 ROCK1 (0.41)

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 3 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
US-20030100554-A1 Pyrazole derivatives JONES LYN HOWARD (GB) 2003-05-29 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-20030100554-A1 Pyrazole derivatives REV1, SARS1, CYP2F1 P2RX7 2065/4885DGAT2 4471/4885P2RX4 2475/4885

“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.