SCHEMBL13048136

SCHEMBL13048136

COC(C(=O)O)[C@@H](NC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.59
HPGD P15428 2/20 0.59
HDAC1 Q13547 1/20 0.54
ALDH1A1 P00352 7/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
TP53 P04637 1/20 0.52
CYP3A4 P08684 2/20 0.48
CYP1A2 P05177 2/20 0.47
CYP2C9 P11712 2/20 0.47
CYP2C19 P33261 2/20 0.47
GAA P10253 2/20 0.47
MAPT P10636 1/20 0.47
TSHR P16473 1/20 0.47
CTRB1 P17538 1/20 0.46
KMT2A Q03164 1/20 0.46
NPC1 O15118 1/20 0.44

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
SCHEMBL13621588 1.00 LMNA (0.59) LMNAHPGDHDAC1ALDH1A1SMN1; SMN2
SCHEMBL14574458 0.85 LMNA (0.56) LMNAHPGDHDAC1ALDH1A1SMN1; SMN2
SCHEMBL13426750 0.84 LMNA (0.59) LMNAHPGDHDAC1ALDH1A1SMN1; SMN2
SCHEMBL14420891 0.84 LMNA (0.59) LMNAHPGDHDAC1ALDH1A1SMN1; SMN2
SCHEMBL6859238 0.83 LMNA (0.51) LMNAHPGDHDAC1ALDH1A1SMN1; SMN2
SCHEMBL6859243 0.83 LMNA (0.51) LMNAHPGDHDAC1ALDH1A1SMN1; SMN2
SCHEMBL17278268 0.82 LMNA (0.54) LMNAHPGDHDAC1ALDH1A1SMN1; SMN2
SCHEMBL14516389 0.81 ALDH1A1 (0.49) LMNAHPGDHDAC1ALDH1A1SMN1; SMN2
SCHEMBL14032267 0.80 LMNA (0.51) LMNAHPGDHDAC1ALDH1A1SMN1; SMN2
SCHEMBL14370539 0.80 LMNA (0.51) LMNAHPGDHDAC1ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100305030-A1 NANOPARTICLES OF THERAPEUTIC AGENTS HAVING LOW WATER SOLUBILITY CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2010-12-02 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-20100305030-A1 NANOPARTICLES OF THERAPEUTIC AGENTS HAVING LOW WATER SOLUBILITY AQP1, CD44, AQP3 LMNA 1111/4885HPGD 192/4885HDAC1 3501/4885

“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.