SCHEMBL29304536

SCHEMBL29304536

C=C1NCC(=O)N1Cc1ccc(OC)cc1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CMA1 P23946 1/20 0.57
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
ALDH1A1 P00352 2/20 0.56
MAPT P10636 1/20 0.56
GSK3A P49840 3/20 0.54
GSK3B P49841 3/20 0.54
L3MBTL1 Q9Y468 2/20 0.52
BLM P54132 1/20 0.52
GAA P10253 3/20 0.48
CASP3 P42574 2/20 0.48
APAF1 O14727 1/20 0.48
SENP8 Q96LD8 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
SENP6 Q9GZR1 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
KDM4E B2RXH2 1/20 0.47
HTT P42858 1/20 0.47

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
SCHEMBL6407514 0.86 MEN1 (0.64) CMA1MEN1KMT2AALDH1A1MAPT
SCHEMBL6525579 0.76 L3MBTL1 (0.56) CMA1MEN1KMT2AALDH1A1MAPT
SCHEMBL41389 0.76 CMA1 (0.70) CMA1MEN1KMT2AALDH1A1MAPT
SCHEMBL23120576 0.75 MEN1 (0.61) CMA1MEN1KMT2AALDH1A1MAPT
SCHEMBL12615721 0.75 GSK3A (0.60) CMA1MEN1KMT2AALDH1A1MAPT
Hydrochloric Acid SCHEMBL30616170 0.73 MEN1 (0.59) CMA1MEN1KMT2AALDH1A1MAPT
SCHEMBL40778 0.73 CMA1 (0.66) CMA1MEN1KMT2AALDH1A1MAPT
SCHEMBL8117134 0.73 CMA1 (0.77) CMA1MEN1KMT2AALDH1A1MAPT
SCHEMBL607289 0.73 KMT2A (0.46) CMA1MEN1KMT2AALDH1A1MAPT
SCHEMBL30327581 0.73 KMT2A (0.46) CMA1MEN1KMT2AALDH1A1MAPT

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-20240228488-A1 HETEROARYL INHIBITORS OF PLASMA KALLIKREIN TAKEDA PHARMACEUTICALS CO (JP) 2024-07-11 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-20240228488-A1 HETEROARYL INHIBITORS OF PLASMA KALLIKREIN KLKB1, KLK5, KLK1 CMA1 134/4885MEN1 1290/4885KMT2A 1222/4885

“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.