SCHEMBL2845267

SCHEMBL2845267

Cc1cccc(Oc2c(F)cccc2C(=O)[C@@H]2CCCN(C(=O)O)C2)c1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.45
RAB9A P51151 1/20 0.45
ALDH1A1 P00352 8/20 0.44
MAPK1 P28482 1/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
TSHR P16473 1/20 0.42
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
PKM P14618 1/20 0.41
FFAR1 O14842 1/20 0.41
PLA2G1B P04054 1/20 0.41
ATG4B Q9Y4P1 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
SCHEMBL4746792 0.88 GPR119 (0.43) GAARAB9AALDH1A1MAPK1MEN1
SCHEMBL5507540 0.78 GAA (0.46) GAARAB9AALDH1A1MAPK1MEN1
SCHEMBL4982747 0.77 HPGD (0.54) GAARAB9AALDH1A1MAPK1MEN1
SCHEMBL3963250 0.75 HPGD (0.56) ALDH1A1MAPK1MEN1KMT2AMAPT
SCHEMBL2844411 0.74 REN (0.49)
SCHEMBL4755321 0.74 FFAR1 (0.38) GAARAB9AALDH1A1MEN1KMT2A
SCHEMBL2847273 0.73 POLB (0.47) ALDH1A1MEN1KMT2ALMNA
SCHEMBL4755206 0.72 POLB (0.52) GAARAB9AALDH1A1MAPK1MEN1
SCHEMBL4071817 0.71 ALDH1A1 (0.59) GAAALDH1A1MEN1KMT2ALMNA
SCHEMBL17913800 0.71 MEN1 (0.68) GAAALDH1A1MAPK1MEN1KMT2A

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-20100179109-A1 RENIN INHIBITORS VITAE PHARMACEUTICALS, INC. 2010-07-15 US disclosed
US-20100130471-A1 Renin Inhibitors SMITHKLINE BEECHAM CORPORATION 2010-05-27 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 (2 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-20100179109-A1 RENIN INHIBITORS REN, ACE, AGTR1 GAA 35/4885RAB9A 236/4885ALDH1A1 1625/4885
US-20100130471-A1 Renin Inhibitors ACE, REN, DNPEP GAA 35/4885RAB9A 463/4885ALDH1A1 2221/4885

“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.