SCHEMBL5285749

SCHEMBL5285749

Cc1ccccc1CC(=O)N[C@H](C)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.49
KDM4E B2RXH2 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
HPGD P15428 1/20 0.47
CTBP2 P56545 1/20 0.47
NPC1 O15118 1/20 0.47
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
MAPK8 P45983 1/20 0.45
HSD17B10 Q99714 1/20 0.45
HTT P42858 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
SCHEMBL5966846 1.00 ALDH1A1 (0.49) ALDH1A1KDM4ESMN1; SMN2HPGDCTBP2
SCHEMBL5843233 0.86 MAPK8 (0.50) ALDH1A1KDM4ESMN1; SMN2HPGDCTBP2
SCHEMBL3668726 0.85 MEN1 (0.50) ALDH1A1KDM4ESMN1; SMN2HPGDCTBP2
SCHEMBL6136600 0.81 POLB (0.50) ALDH1A1HPGDCTBP2NPC1MEN1
SCHEMBL5285183 0.81 CYP2C9 (0.50) ALDH1A1MEN1KMT2AHTT
SCHEMBL6136454 0.80 LMNA (0.62) ALDH1A1KDM4ESMN1; SMN2HPGDMEN1
SCHEMBL6136455 0.80 LMNA (0.62) ALDH1A1KDM4ESMN1; SMN2HPGDMEN1
SCHEMBL7139605 0.80 KDM4E (0.60) ALDH1A1KDM4EHPGDMEN1KMT2A
SCHEMBL6239035 0.80 KDM4E (0.60) ALDH1A1KDM4EHPGDMEN1KMT2A
SCHEMBL7144643 0.80 KDM4E (0.60) ALDH1A1KDM4EHPGDMEN1KMT2A

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
WO-2007001335-A2 RAMOPLANIN DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARMACEUTICALS INC. (US) 2007-01-04 WO disclosed
US-20060211603-A1 Ramoplanin derivatives possessing antibacterial activity VICURON PHARMACEUTICALS INC. (US) 2006-09-21 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-20060211603-A1 Ramoplanin derivatives possessing antibacterial activity CLSPN, LMAN2, RPN2 ALDH1A1 2972/4885KDM4E 4305/4885SMN1; SMN2 3894/4885

“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.