SCHEMBL5457959

SCHEMBL5457959

COc1ncccc1NC(=O)Nc1ccc(N2CCN(C(=O)O)CC2)cc1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
P2RY1 P47900 10/20 0.58
MAPT P10636 6/20 0.52
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
LMNA P02545 2/20 0.46
SLC1A2 P43004 1/20 0.46
TP53 P04637 1/20 0.46
MAPK1 P28482 1/20 0.46
MECP2 P51608 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
P2RY14 Q15391 1/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
PTPN7 P35236 1/20 0.43
CA9 Q16790 1/20 0.43

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
SCHEMBL5459969 0.87 P2RY1 (0.58) P2RY1MAPTNPC1RAB9AMEN1
SCHEMBL5470896 0.86 P2RY1 (0.71) P2RY1MAPTNPC1RAB9AMEN1
SCHEMBL5470998 0.85 RAB9A (0.53) P2RY1MAPTNPC1RAB9AKMT2A
SCHEMBL5452159 0.83 MAPT (0.52) P2RY1MAPTNPC1RAB9AMEN1
SCHEMBL5465394 0.82 RAB9A (0.75) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL8699365 0.81 ALDH1A1 (0.58) MAPTMEN1KMT2ALMNATP53
SCHEMBL5455899 0.80 MAPT (0.53) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL5458486 0.80 MAPT (0.61) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL8703388 0.79 MAPT (0.67) MAPTRAB9AKMT2ALMNATP53
SCHEMBL5550233 0.79 RAF1 (0.55) MAPTNPC1RAB9AMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070249620-A1 Urea Derivative SANKYO COMPANY, LIMITED (JP) 2007-10-25 US disclosed
EP-1764360-A1 UREA DERIVATIVE Sankyo Company, Limited (JP) 2007-03-21 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-20070249620-A1 Urea Derivative UGP2, SLC14A1, DGAT1 P2RY1 3474/4885MAPT 758/4885NPC1 1089/4885

“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.