SCHEMBL8255076

SCHEMBL8255076

Cc1ccc2ccn(CCCCC(=O)O)c2c1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMO O15229 2/20 0.56
MCL1 Q07820 9/20 0.55
P2RX7 Q99572 1/20 0.52
HTR2A P28223 1/20 0.48
HTR2C P28335 1/20 0.48
HTR7 P34969 1/20 0.47
OXER1 Q8TDS5 1/20 0.43
CDK4 P11802 1/20 0.42
CCND1 P24385 1/20 0.42
ACLY P53396 1/20 0.42

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
SCHEMBL27898692 0.80 KMT2A (0.60) KMOMCL1P2RX7HTR2AHTR2C
SCHEMBL1269116 0.79 CDK4 (0.71) CDK4CCND1
SCHEMBL419751 0.78 KMO (0.57) KMOMCL1P2RX7HTR2AHTR2C
SCHEMBL7258387 0.78 KMO (0.57) KMOMCL1HTR7OXER1
SCHEMBL13345643 0.78 KMO (0.56) KMOMCL1HTR2AHTR2CCDK4
SCHEMBL19783673 0.78 CDK4 (0.72) CDK4CCND1
SCHEMBL30582936 0.78 CDK4 (0.72) CDK4CCND1
SCHEMBL10923807 0.78 HTR7 (0.51) KMOMCL1HTR7CDK4CCND1
SCHEMBL19149287 0.77 HTR7 (0.50) KMOMCL1P2RX7HTR2AHTR2C
SCHEMBL9479598 0.76 HDAC3 (0.59) KMOOXER1

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-20090137566-A1 Substituted Piperdines as Renin Inhibitors EHARA TAKERU 2009-05-28 US disclosed
WO-2006125621-A1 SUBSTITUTED PIPERIDINES AS RENIN INHIBITORS NOVARTIS AG (CH) 2006-11-30 WO 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-20090137566-A1 Substituted Piperdines as Renin Inhibitors REN, ACE, AGTR1 KMO 1360/4885MCL1 4645/4885P2RX7 584/4885

“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.