SCHEMBL5405356

SCHEMBL5405356

O=C(O)CCN(Cc1ccccc1)C(=O)c1ccccc1-c1ccccc1C(=O)NCc1ccccn1

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.60
HTT P42858 1/20 0.60
HPGD P15428 4/20 0.50
ALDH1A1 P00352 2/20 0.50
POLB P06746 2/20 0.49
KMT2A Q03164 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
ALOX15 P16050 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
MEN1 O00255 1/20 0.46
HSD17B10 Q99714 1/20 0.46
KCNK3 O14649 1/20 0.46
KCNA3 P22001 1/20 0.46
KCNA5 P22460 1/20 0.46
RAB9A P51151 2/20 0.45
NPC1 O15118 1/20 0.45
L3MBTL1 Q9Y468 2/20 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
SCHEMBL5401124 0.93 LMNA (0.54) LMNAHTTHPGDALDH1A1POLB
SCHEMBL5406707 0.92 HTT (0.53) LMNAHTTHPGDALDH1A1POLB
SCHEMBL5403484 0.91 LMNA (0.58) LMNAHTTHPGDALDH1A1POLB
SCHEMBL5392825 0.91 KMT2A (0.53) LMNAHTTHPGDALDH1A1KMT2A
SCHEMBL5409823 0.90 LMNA (0.57) LMNAHTTHPGDALDH1A1POLB
SCHEMBL5402839 0.88 LMNA (0.61) LMNAHTTHPGDALDH1A1POLB
SCHEMBL5400848 0.87 CHRNB2 (0.57) LMNAHTTHPGDKMT2ASMN1; SMN2
SCHEMBL5399581 0.86 LMNA (0.55) LMNAHTTHPGDALDH1A1POLB
SCHEMBL5416783 0.86 HTT (0.53) LMNAHTTHPGDALDH1A1POLB
SCHEMBL5414055 0.84 LMNA (0.53) LMNAHTTHPGDALDH1A1KMT2A

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-7285680-B2 β-alanine derivatives and the use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2007-10-23 US disclosed
US-20050256160-A1 Beta-alanine derivatives and the use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2005-11-17 US disclosed
EP-1533294-A1 BETA-ALANINE DERIVATIVE AND USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2005-05-25 EP 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-20050256160-A1 Beta-alanine derivatives and the use thereof TGFB1, PML, APOB LMNA 308/4885HTT 3791/4885HPGD 1078/4885

“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.