SCHEMBL4518274

SCHEMBL4518274

Cc1cc(C)nc(NC(=O)N2CCCC(COc3ccccc3Cl)C2)c1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.52
MEN1 O00255 2/20 0.52
MAPT P10636 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
KDM4E B2RXH2 1/20 0.52
PKM P14618 1/20 0.52
TRPV1 Q8NER1 1/20 0.45
F2 P00734 1/20 0.44
F10 P00742 1/20 0.44
PRSS2 P07478 1/20 0.44
CTRC Q99895 1/20 0.44
LOXL2 Q9Y4K0 2/20 0.44
NPC1 O15118 2/20 0.43
PHGDH O43175 4/20 0.43
RBP4 P02753 4/20 0.43
TTR P02766 2/20 0.43
RAB9A P51151 1/20 0.41
GRM5 P41594 2/20 0.41

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
SCHEMBL4509117 0.95 MEN1 (0.53) KMT2AMEN1MAPTSMN1; SMN2KDM4E
SCHEMBL4491951 0.91 SMN1; SMN2 (0.50) KMT2AMEN1MAPTSMN1; SMN2KDM4E
SCHEMBL4516123 0.90 CYP1A2 (0.43) KMT2AMEN1MAPTSMN1; SMN2KDM4E
SCHEMBL4509367 0.83 MEN1 (0.51) KMT2AMEN1MAPTSMN1; SMN2KDM4E
SCHEMBL4506541 0.79 CYP1A2 (0.46) KMT2AMEN1MAPTSMN1; SMN2KDM4E
SCHEMBL4516917 0.75 EPHA2 (0.44) KMT2AMEN1MAPTSMN1; SMN2KDM4E
SCHEMBL4496434 0.73 LOXL2 (0.46) KMT2AMEN1MAPTSMN1; SMN2LOXL2
SCHEMBL4499618 0.73 LOXL2 (0.42) KMT2AMEN1SMN1; SMN2LOXL2RBP4
SCHEMBL4509555 0.73 SCN9A (0.54) KMT2AMEN1RBP4
SCHEMBL4506372 0.73 TRPV1 (0.43) KMT2AMEN1MAPTSMN1; SMN2KDM4E

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-20090325956-A1 Aromatic amine derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-12-31 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-20090325956-A1 Aromatic amine derivative and use thereof SCD, SCD5, SMS KMT2A 1109/4885MEN1 4180/4885MAPT 4022/4885

“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.