SCHEMBL8248682

SCHEMBL8248682

CSCC[C@H](NC(CC(C)C)C(=O)O)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 3/20 0.58
ALDH1A1 P00352 5/20 0.47
LMNA P02545 3/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
RNPEP Q9H4A4 1/20 0.44
MAPT P10636 1/20 0.42
GAA P10253 2/20 0.42
NPSR1 Q6W5P4 1/20 0.41
KDM4E B2RXH2 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PKM P14618 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40

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
SCHEMBL5869722 1.00 FOLH1 (0.58) FOLH1ALDH1A1LMNAMEN1KMT2A
SCHEMBL8928051 0.89 RNPEP (0.54) FOLH1ALDH1A1LMNARNPEPGAA
SCHEMBL27602423 0.86 FOLH1 (0.58) FOLH1ALDH1A1LMNAMEN1KMT2A
SCHEMBL15592739 0.83 LMNA (0.51) FOLH1ALDH1A1LMNARNPEPGAA
SCHEMBL9911535 0.83 LMNA (0.51) FOLH1ALDH1A1LMNARNPEPGAA
SCHEMBL8023768 0.83 FNTA (0.43) FOLH1ALDH1A1LMNARNPEPNPSR1
SCHEMBL8255152 0.81 RNPEP (0.47) FOLH1ALDH1A1LMNARNPEPGAA
SCHEMBL8255575 0.81 RNPEP (0.47) FOLH1ALDH1A1LMNARNPEPGAA
SCHEMBL30642009 0.81 RNPEP (0.47) FOLH1ALDH1A1LMNARNPEPGAA
SCHEMBL29561871 0.81 RNPEP (0.47) FOLH1ALDH1A1LMNARNPEPGAA

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-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

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 FOLH1 229/4885ALDH1A1 1305/4885LMNA 3320/4885

“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.