SCHEMBL5459753

SCHEMBL5459753

COc1c(C)cccc1NC(=O)Nc1ccc(N2CCN(C(=O)Nc3ncc(F)cc3F)CC2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.45
KDM4E B2RXH2 4/20 0.45
SMN1; SMN2 Q16637 4/20 0.45
HSD17B10 Q99714 3/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
USP2 O75604 1/20 0.45
ALK Q9UM73 1/20 0.43
GLA P06280 1/20 0.42
HTR1A P08908 1/20 0.42
HTR1D P28221 1/20 0.42
HTR1B P28222 1/20 0.42
HTR2A P28223 1/20 0.42
P2RX7 Q99572 1/20 0.42
POLB P06746 2/20 0.42
ALDH1A1 P00352 2/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA9 Q16790 1/20 0.42

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
SCHEMBL5460786 0.92 MAPT (0.48) MAPTKDM4ESMN1; SMN2HSD17B10NPC1
SCHEMBL5465363 0.85 RAB9A (0.52) MAPTKDM4ESMN1; SMN2HSD17B10NPC1
SCHEMBL5473636 0.84 MAPT (0.51) MAPTKDM4ESMN1; SMN2NPC1RAB9A
SCHEMBL5455789 0.84 ALK (0.51) MAPTSMN1; SMN2NPC1RAB9AALK
SCHEMBL5465526 0.83 GLA (0.47) MAPTKDM4ESMN1; SMN2HSD17B10NPC1
SCHEMBL5455973 0.82 TRPV1 (0.51) MAPTKDM4ESMN1; SMN2HSD17B10NPC1
SCHEMBL5460880 0.82 MAPT (0.49) MAPTKDM4ESMN1; SMN2NPC1RAB9A
SCHEMBL5459135 0.81 GLA (0.48) MAPTKDM4ESMN1; SMN2HSD17B10NPC1
SCHEMBL5460053 0.81 GLA (0.48) MAPTKDM4ESMN1; SMN2HSD17B10NPC1
SCHEMBL5459962 0.80 PANK3 (0.47) MAPTKDM4ESMN1; SMN2HSD17B10NPC1

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-20070249620-A1 Urea Derivative SANKYO COMPANY, LIMITED (JP) 2007-10-25 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-20070249620-A1 Urea Derivative UGP2, SLC14A1, DGAT1 MAPT 758/4885KDM4E 2284/4885SMN1; SMN2 4424/4885

“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.