SCHEMBL5555530

SCHEMBL5555530

CC(C)C[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)NCCCCCC(=O)NN

nearest known ligand 0.67

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.54
CAPN1 P07384 1/20 0.52
CAPN2 P17655 1/20 0.52
PTPN1 P18031 3/20 0.46
TLR2 O60603 6/20 0.46

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
SCHEMBL14599747 1.00 KMT2A (0.54) KMT2ACAPN1CAPN2PTPN1TLR2
SCHEMBL13124052 0.88 TLR2 (0.55) KMT2ACAPN1CAPN2PTPN1TLR2
SCHEMBL5555627 0.86 CAPN1 (0.50) KMT2ACAPN1CAPN2PTPN1TLR2
SCHEMBL14599748 0.86 CAPN1 (0.50) KMT2ACAPN1CAPN2PTPN1TLR2
SCHEMBL14264914 0.84 PTPN1 (0.52) KMT2APTPN1
SCHEMBL5550978 0.83 KMT2A (0.76) KMT2ATLR2
SCHEMBL4413564 0.83 KMT2A (0.52) KMT2ACAPN1CAPN2PTPN1TLR2
SCHEMBL5557617 0.82 KMT2A (0.55) KMT2ACAPN1CAPN2PTPN1
SCHEMBL14599759 0.82 KMT2A (0.55) KMT2ACAPN1CAPN2PTPN1
SCHEMBL5556637 0.81 KMT2A (0.54) KMT2ACAPN1CAPN2TLR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070014721-A1 Hydrazide conjugates as imaging agents LANTHEUS MEDICAL IMAGING, INC. 2007-01-18 US disclosed
US-20070014721-A1 Hydrazide conjugates as imaging agents LANTHEUS MEDICAL IMAGING, INC. 2007-01-18 US disclosed
WO-2007005491-A1 HYDRAZIDE CONJUGATES AS IMAGING AGENTS BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2007-01-11 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-20070014721-A1 Hydrazide conjugates as imaging agents CA14, CA13, CA1 KMT2A 2223/4885CAPN1 679/4885CAPN2 1188/4885

“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.