SCHEMBL8249019

SCHEMBL8249019

CCOC(=O)C(CCc1ccccc1)N[C@@H](CC(C)C)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
REN P00797 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.52
ACE P12821 8/20 0.52
LMNA P02545 2/20 0.52
MME P08473 1/20 0.51
ABCB11 O95342 1/20 0.50
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
USP2 O75604 1/20 0.48
CYP3A4 P08684 1/20 0.48
ALOX15 P16050 1/20 0.48
CTSL P07711 1/20 0.47

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
SCHEMBL8640334 1.00 REN (0.56) RENSMN1; SMN2ACELMNAMME
SCHEMBL5870272 1.00 REN (0.56) RENSMN1; SMN2ACELMNAMME
Hydrochloric Acid SCHEMBL10703732 0.99 REN (0.56) RENSMN1; SMN2ACELMNAMME
Hydrochloric Acid SCHEMBL10703729 0.99 REN (0.56) RENSMN1; SMN2ACELMNAMME
SCHEMBL8257832 0.91 REN (0.56) RENSMN1; SMN2ACELMNAABCB11
SCHEMBL8435225 0.91 REN (0.56) RENSMN1; SMN2ACELMNAABCB11
SCHEMBL8248581 0.89 MME (0.62) ACEMME
SCHEMBL8248814 0.89 MME (0.62) ACEMME
SCHEMBL8249153 0.89 MME (0.62) ACEMME
SCHEMBL8248719 0.89 MME (0.62) ACEMME

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040082496-A1 ACE-2 modulating compounds and methods of use thereof MILLENNIUM PHARMACEUTICALS, INC. 2004-04-29 US disclosed
US-20040082496-A1 ACE-2 modulating compounds and methods of use thereof MILLENNIUM PHARMACEUTICALS, INC. 2004-04-29 US disclosed
EP-0243645-B1 Compounds having a nootropic activity, agents containing them and their use in the treatment and prophylaxis of cognitive malfunctions HOECHST AG (DE) 1994-03-16 EP disclosed
US-5231084-A ACE inhibitor HOECHST AKTIENGESELLSCHAFT (DE) 1993-07-27 US disclosed
EP-0243645-A2 Compounds having a nootropic activity, agents containing them and their use in the treatment and prophylaxis of cognitive malfunctions HOECHST AKTIENGESELLSCHAFT (DE) 1987-11-04 EP 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-20040082496-A1 ACE-2 modulating compounds and methods of use thereof ACE, ACE2, AGTR2 REN 7/4885SMN1; SMN2 3028/4885ACE 1/4885

“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.