SCHEMBL684463

SCHEMBL684463

CCC(=O)[C@H]1CNC[C@@H]1c1ccc(Cl)cc1F

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PRCP P42785 8/20 0.43
HTR2C P28335 3/20 0.43
HTR2A P28223 1/20 0.43
HTR2B P41595 1/20 0.43
MC4R P32245 4/20 0.42
FPR1 P21462 3/20 0.41
FPR2 P25090 2/20 0.41
KCNH2 Q12809 1/20 0.41
ROCK2 O75116 1/20 0.38
DPP4 P27487 1/20 0.37

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
SCHEMBL12104061 1.00 PRCP (0.43) PRCPHTR2CHTR2AHTR2BMC4R
SCHEMBL684171 0.85 PRCP (0.45) PRCPHTR2CHTR2AHTR2BMC4R
SCHEMBL8223289 0.85 PRCP (0.45) PRCPHTR2CHTR2AHTR2BMC4R
SCHEMBL29904547 0.84 PRCP (0.46) PRCPHTR2CHTR2AHTR2BMC4R
SCHEMBL14310837 0.83 HTR2C (0.46) PRCPHTR2CHTR2AHTR2BMC4R
Hydrochloric Acid SCHEMBL28643755 0.83 HTR2C (0.46) PRCPHTR2CHTR2AHTR2BMC4R
SCHEMBL13012434 0.83 HTR2C (0.43) PRCPHTR2CHTR2AHTR2BMC4R
SCHEMBL21036774 0.82 FPR1 (0.44) PRCPHTR2CHTR2AHTR2BMC4R
SCHEMBL21036775 0.82 FPR1 (0.44) PRCPHTR2CHTR2AHTR2BMC4R
SCHEMBL679794 0.82 PRCP (0.43) PRCPHTR2CHTR2AHTR2BMC4R

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-2966065-A2 HYDROXYLATED AND METHOXYLATED CYCLOPENTA [D] PYRIMIDINES AS AKT PROTEIN KINASE INHIBITORS Array Biopharma, Inc. (US) 2016-01-13 EP disclosed
US-8063050-B2 Hydroxylated and methoxylated pyrimidyl cyclopentanes as AKT protein kinase inhibitors ARRAY BIOPHARMA INC. (US) 2011-11-22 US disclosed
US-20080051399-A1 HYDROXYLATED AND METHOXYLATED PYRIMIDYL CYCLOPENTANES AS AKT PROTEIN KINASE INHIBITORS ARRAY BIOPHARMA INC. 2008-02-28 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-20080051399-A1 HYDROXYLATED AND METHOXYLATED PYRIMIDYL CYCLOPENTANES AS AKT PROTEIN KINASE INHIBITORS AKT1, AKT2, AKT1S1 PRCP 2180/4885HTR2C 1003/4885HTR2A 1733/4885

“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.