SCHEMBL14400855

SCHEMBL14400855

C[C@@H](O)C(NC(=O)c1ccc(-c2ccc(NC(=O)CN(C)C)cc2)cc1)C(=O)NO

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.44
TAAR1 Q96RJ0 1/20 0.44
MAPT P10636 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
PPARG P37231 1/20 0.39
ALDH1A1 P00352 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
TUBB4A P04350 1/20 0.39
TUBB P07437 1/20 0.39
TUBA3C P0DPH7 1/20 0.39
TUBA1B P68363 1/20 0.39
TUBA4A P68366 1/20 0.39
TUBB4B P68371 1/20 0.39
TUBB3 Q13509 1/20 0.39
TUBB2A Q13885 1/20 0.39
TUBB8 Q3ZCM7 1/20 0.39
TUBA3E Q6PEY2 1/20 0.39
TUBA1A Q71U36 1/20 0.39
TUBA1C Q9BQE3 1/20 0.39

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
SCHEMBL1912152 1.00 PTPN1 (0.44) PTPN1TAAR1MAPTMEN1KMT2A
SCHEMBL1109155 1.00 PTPN1 (0.44) PTPN1TAAR1MAPTMEN1KMT2A
SCHEMBL1109597 0.91 MEN1 (0.43) PTPN1MEN1KMT2APPARGALDH1A1
SCHEMBL1109127 0.91 ALDH1A1 (0.40) PTPN1ALDH1A1
SCHEMBL402607 0.90
SCHEMBL1109356 0.90 PTPN1 (0.41) PTPN1MEN1KMT2APPARGALDH1A1
SCHEMBL12064341 0.90 PTPN1 (0.43) PTPN1MEN1KMT2APPARGALDH1A1
SCHEMBL1912256 0.89 PTPN1 (0.43) PTPN1MEN1KMT2APPARGALDH1A1
SCHEMBL1109336 0.89 PTPN1 (0.40) PTPN1MEN1KMT2APPARG
SCHEMBL1109141 0.89 ALDH1A1 (0.46) PTPN1MAPTKMT2APPARGALDH1A1

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-20070244197-A1 Antibacterial agents UNIVERSITY OF WASHINGTON (US) 2007-10-18 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-20070244197-A1 Antibacterial agents MRPL21, SI, PGLS PTPN1 2974/4885TAAR1 4575/4885MAPT 4619/4885

“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.