SCHEMBL7201072

SCHEMBL7201072

CCCCCCCCCCCCCCCCCCN[C@@H](CS)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOD1 Q9Y239 2/20 0.49
MAPT P10636 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
KDM4E B2RXH2 1/20 0.46
THRB P10828 1/20 0.46
ALOX15 P16050 1/20 0.46
NFKB1 P19838 1/20 0.46
PTGS2 P35354 1/20 0.46
THPO P40225 1/20 0.46
RECQL P46063 1/20 0.46
BLM P54132 1/20 0.46
EPHX1 P07099 6/20 0.44
ACE P12821 1/20 0.42
FNTA P49354 1/20 0.41
FNTB P49356 1/20 0.41
GPR84 Q9NQS5 3/20 0.41
FFAR1 O14842 1/20 0.41
PLA2G2A P14555 2/20 0.41
PLA2G5 P39877 2/20 0.41
CASP2 P42575 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
SCHEMBL252667 1.00 NOD1 (0.49) NOD1MAPTSMN1; SMN2KDM4ETHRB
SCHEMBL931570 1.00 NOD1 (0.49) NOD1MAPTSMN1; SMN2KDM4ETHRB
SCHEMBL252666 1.00 NOD1 (0.49) NOD1MAPTSMN1; SMN2KDM4ETHRB
SCHEMBL931571 1.00 NOD1 (0.49) NOD1MAPTSMN1; SMN2KDM4ETHRB
SCHEMBL8612865 1.00 NOD1 (0.49) NOD1MAPTSMN1; SMN2KDM4ETHRB
SCHEMBL25211227 1.00 NOD1 (0.49) NOD1MAPTSMN1; SMN2KDM4ETHRB
SCHEMBL21243388 1.00 NOD1 (0.49) NOD1MAPTSMN1; SMN2KDM4ETHRB
SCHEMBL21291888 1.00 NOD1 (0.49) NOD1MAPTSMN1; SMN2KDM4ETHRB
SCHEMBL20553468 1.00 NOD1 (0.49) NOD1MAPTSMN1; SMN2KDM4ETHRB
SCHEMBL5801833 1.00 NOD1 (0.49) NOD1MAPTSMN1; SMN2KDM4ETHRB

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-20030134420-A1 Methods and compositions for gene delivery IMMUNE RESPONSE CORPORATION, THE 2003-07-17 US disclosed
WO-2001060415-A1 METHODS AND COMPOSITIONS FOR GENE DELIVERY THE IMMUNE RESPONSE CORPORATION (US) 2001-08-23 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-20030134420-A1 Methods and compositions for gene delivery POLRMT, NUP205, POLM NOD1 3925/4885MAPT 2431/4885SMN1; SMN2 204/4885

“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.