SCHEMBL6800581

SCHEMBL6800581

O=C(Nc1ccc(NCCc2ccccn2)nc1)c1ccccc1-c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.46
KMT2A Q03164 2/20 0.46
CRHBP P24387 1/20 0.46
CRHR2 Q13324 1/20 0.46
KDR P35968 1/20 0.45
SMO Q99835 4/20 0.45
ABL1 P00519 4/20 0.45
PGR P06401 1/20 0.45
GPR183 P32249 1/20 0.45
MEN1 O00255 1/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
TRPV1 Q8NER1 1/20 0.41
KCNH2 Q12809 1/20 0.41
SCN5A Q14524 1/20 0.41
SCN9A Q15858 1/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 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
SCHEMBL6795019 0.91 KDR (0.52) MAPTKMT2AKDRSMOABL1
SCHEMBL7085666 0.90 ABL1 (0.43) MAPTKMT2ACRHBPCRHR2KDR
SCHEMBL6795426 0.89 SMO (0.56) KDRSMONPC1RAB9ATRPV1
SCHEMBL6794939 0.85 HTR2C (0.48) MAPTKMT2AKDRSMOABL1
SCHEMBL6794367 0.84 SMO (0.48) MAPTKMT2AKDRSMOABL1
SCHEMBL6794029 0.84 MAPT (0.49) MAPTKMT2AKDRSMOABL1
SCHEMBL6487848 0.82 SMO (0.46) MAPTKMT2ASMOMEN1NPC1
SCHEMBL6791040 0.81 PKM (0.49) MAPTKMT2AKDRSMOABL1
SCHEMBL6793719 0.81 SMO (0.49) MAPTKMT2ASMOMEN1NPC1
SCHEMBL6788429 0.81 KDR (0.52) MAPTKMT2ACRHBPCRHR2KDR

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-20040058903-A1 Benzamide compounds as apo b secretion inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-03-25 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-20040058903-A1 Benzamide compounds as apo b secretion inhibitors APOB, APOL1, SCARB1 MAPT 4795/4885KMT2A 2457/4885CRHBP 2860/4885

“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.