SCHEMBL8145116

SCHEMBL8145116

CCc1nc(C(O)[C@@H](N)CC2CCCCC2)no1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
REN P00797 2/20 0.39
METAP2 P50579 8/20 0.36
METAP1 P53582 7/20 0.35
ALDH1A1 P00352 1/20 0.32
RAB9A P51151 1/20 0.32
IDO1 P14902 3/20 0.31
TDO2 P48775 3/20 0.31
F2RL1 P55085 1/20 0.31

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
SCHEMBL2163676 0.78 KDM4E (0.33)
SCHEMBL2163672 0.78 KDM4E (0.33)
SCHEMBL5954975 0.78 KDM4E (0.33)
SCHEMBL13134804 0.76 BMP1 (0.38) RENMETAP2METAP1
Trifluoroacetic Acid SCHEMBL5397425 0.68 DPP7 (0.34)
SCHEMBL3870308 0.65 SMYD3 (0.36) RAB9A
SCHEMBL8291616 0.65 SMYD3 (0.36) RAB9A
SCHEMBL3870311 0.65 SMYD3 (0.36) RAB9A
SCHEMBL10177642 0.62 POLB (0.46) ALDH1A1RAB9A
SCHEMBL7274162 0.62 REN (0.55) RENMETAP2METAP1ALDH1A1

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
US-20100239551-A1 COMPOUNDS AND COMPOSITIONS AS CHANNEL ACTIVATING PROTEASE INHIBITORS IRM LLC (BM) 2010-09-23 US disclosed
US-20100239551-A1 COMPOUNDS AND COMPOSITIONS AS CHANNEL ACTIVATING PROTEASE INHIBITORS IRM LLC (BM) 2010-09-23 US disclosed
WO-2008097673-A1 COMPOUNDS AND COMPOSITIONS AS CHANNEL ACTIVATING PROTEASE INHIBITORS IRM LLC (BM) 2008-08-14 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-20100239551-A1 COMPOUNDS AND COMPOSITIONS AS CHANNEL ACTIVATING PROTEASE INHIBITORS PRSS8, PRSS1, PRSS2 REN 972/4885METAP2 356/4885METAP1 282/4885

“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.