SCHEMBL12893012

SCHEMBL12893012

CC(C)(F)c1cccc(CCNC(=O)c2cccc3c2cnn3-c2ccc(Cl)c(Cl)c2)c1

nearest known ligand 0.73

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 18/20 0.73
HSP90AA1 P07900 1/20 0.46
MAPT P10636 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
P2RX7 Q99572 1/20 0.45

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
SCHEMBL1135662 0.93 CCR1 (0.84) CCR1HSP90AA1MAPTNPSR1P2RX7
SCHEMBL1255893 0.87 CCR1 (0.65) CCR1P2RX7
SCHEMBL1256413 0.86 CCR1 (0.67) CCR1MAPTP2RX7
SCHEMBL1135688 0.84 CCR1 (1.00) CCR1
SCHEMBL13622412 0.83 CCR1 (0.70) CCR1HSP90AA1MAPTNPSR1
SCHEMBL12892996 0.80 CCR1 (0.59) CCR1
SCHEMBL12893002 0.78 CCR1 (0.75) CCR1
SCHEMBL12315396 0.78 CCR1 (0.87) CCR1
SCHEMBL13621749 0.76 CCR1 (0.54) CCR1P2RX7
SCHEMBL13621767 0.76 CCR1 (0.51) CCR1MAPTP2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110034512-A1 Indazole Compounds As CCR1 Receptor Antagonists BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-02-10 US disclosed
US-20110034512-A1 Indazole Compounds As CCR1 Receptor Antagonists BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-02-10 US 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-20110034512-A1 Indazole Compounds As CCR1 Receptor Antagonists CCR1, CCR3, CCRL2 CCR1 1/4885HSP90AA1 2906/4885MAPT 2838/4885

“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.