SCHEMBL6451591

SCHEMBL6451591

CC(=O)c1cccc(NC(=O)[C@@H]2CCCN2C(=O)c2cccc(C(C)=O)c2)c1

nearest known ligand 0.72

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.72
ALDH1A1 P00352 5/20 0.67
POLB P06746 1/20 0.64
KMT2A Q03164 1/20 0.64
MAPK1 P28482 1/20 0.62
USP2 O75604 2/20 0.59
TSHR P16473 1/20 0.57
NPSR1 Q6W5P4 1/20 0.57

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
SCHEMBL6459743 1.00 GAA (0.72) GAAALDH1A1POLBKMT2AMAPK1
SCHEMBL6452966 0.83 NPC1 (0.78) GAAALDH1A1POLBKMT2AMAPK1
SCHEMBL31722815 0.82 ALDH1A1 (0.60) GAAALDH1A1POLBMAPK1NPSR1
SCHEMBL6455841 0.78 LMNA (0.74) KMT2A
SCHEMBL6455832 0.78 LMNA (0.74) KMT2A
SCHEMBL13753555 0.78 MEN1 (0.62) GAAKMT2AMAPK1
SCHEMBL6787214 0.76 CA2 (0.59)
SCHEMBL6787220 0.76 CA2 (0.59)
SCHEMBL10200305 0.75 NPC1 (0.67) GAAALDH1A1POLBKMT2ANPSR1
SCHEMBL845157 0.75 ALDH1A1 (0.57) ALDH1A1KMT2AMAPK1TSHRNPSR1

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-20050187409-A1 Inhibitors of RNase P proteins as antibacterial compounds POWERS GORDON D (US) 2005-08-25 US disclosed
WO-2005039494-A2 INHIBITORS OF RNASE P PROTEINS AS ANTIBACTERIAL COMPOUNDS MESSAGE PHARMACEUTICALS, INC. (US) 2005-05-06 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-20050187409-A1 Inhibitors of RNase P proteins as antibacterial compounds RNASEH1, RNASEL, RNASE1 GAA 118/4885ALDH1A1 2005/4885POLB 308/4885

“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.