SCHEMBL5469288

SCHEMBL5469288

O=C(Nc1ccc(N2CCNCC2)cc1)Nc1ccccc1OC(F)(F)F

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
P2RY1 P47900 13/20 0.59
NPC1 O15118 2/20 0.56
MAPT P10636 2/20 0.56
RAB9A P51151 2/20 0.56
CXCR2 P25025 2/20 0.49
KIT P10721 1/20 0.46
KDR P35968 1/20 0.46
FLT3 P36888 1/20 0.46
KDM4E B2RXH2 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
MT-CO2 P00403 1/20 0.45
IDH1 O75874 1/20 0.45

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
SCHEMBL10218438 0.89 MAPT (0.58) P2RY1NPC1MAPTRAB9AKDM4E
SCHEMBL5459132 0.86 MAPT (0.55) P2RY1NPC1MAPTRAB9AKIT
SCHEMBL5460083 0.85 RAB9A (0.77) P2RY1NPC1MAPTRAB9AKDM4E
SCHEMBL5460745 0.84 MAPT (0.56) P2RY1NPC1MAPTRAB9AKDM4E
SCHEMBL5455863 0.82 KMT2A (0.62) P2RY1NPC1MAPTRAB9AKDM4E
SCHEMBL5465589 0.81 NAMPT (0.58) P2RY1NPC1MAPTRAB9A
SCHEMBL5465662 0.81 NPC1 (0.59) P2RY1NPC1MAPTRAB9AKDM4E
SCHEMBL5460057 0.79 P2RY1 (0.57) P2RY1NPC1MAPTRAB9ANPSR1
SCHEMBL5460707 0.79 MT-CO2 (0.61) P2RY1NPC1MAPTRAB9AKDM4E
SCHEMBL5462720 0.78 RAB9A (0.62) P2RY1NPC1MAPTRAB9AMT-CO2

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 3474/4885NPC1 1089/4885MAPT 758/4885

“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.