SCHEMBL6535264

SCHEMBL6535264

CNc1ccc(C(F)(F)F)c(C)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.46
KIF11 P52732 3/20 0.44
RAPGEF4 Q8WZA2 1/20 0.40
PDK2 Q15119 1/20 0.37
KDR P35968 5/20 0.36
FLT1 P17948 4/20 0.36
HTT P42858 2/20 0.36
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
DAO P14920 1/20 0.36
TAS2R14 Q9NYV8 1/20 0.36
PDE2A O00408 1/20 0.35
TRPV1 Q8NER1 1/20 0.35
FFAR4 Q5NUL3 1/20 0.33
CYP17A1 P05093 1/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL30750830 0.83 RAPGEF4 (0.40) ARKIF11RAPGEF4KDRFLT1
SCHEMBL20205053 0.83 TAS2R14 (0.49) ARKIF11RAPGEF4PDK2KDR
SCHEMBL14267822 0.83 AR (0.49) ARKIF11RAPGEF4PDK2KDR
SCHEMBL10227623 0.81 NR1H4 (0.36) ARKIF11PDK2HTTLMNA
SCHEMBL8167857 0.79 KIF11 (0.50) ARKIF11
SCHEMBL23974249 0.79 CCNE2 (0.43) KIF11RAPGEF4KDRFLT1HTT
SCHEMBL6535322 0.79 AR (0.50) ARRAPGEF4KDRFLT1HTT
SCHEMBL11187639 0.78 KIF11 (0.49) ARKIF11PDK2FFAR4
SCHEMBL29886486 0.78 NOTUM (0.49) ARKIF11PDK2HTTLMNA
SCHEMBL23974264 0.78 NOTUM (0.49) ARKIF11PDK2HTTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100267945-A1 AMINE DERIVATIVE HAVING NPY Y5 RECEPTOR ANTAGONISTIC ACTIVITY SHIONOGI & CO., LTD. (JP) 2010-10-21 US disclosed
EP-1207874-A4 METHODS OF TREATING PROLIFERATIVE DISORDERS BIOMEDICINES INC (US) 2004-02-11 EP disclosed
US-6566395-B1 Therapy of proliferative disorders, such as cancers, blood vessel disorders and fibrotic disorders by administering N-(3-methyl-4- trifluoromethylphenyl) 2-cyano-2-(cycloalkylcarbonyl)acetamide compounds BIOMEDICINES, INC. 2003-05-20 US disclosed
EP-1207874-A1 METHODS OF TREATING PROLIFERATIVE DISORDERS Biomedicines, Inc. (US) 2002-05-29 EP disclosed
WO-2000071113-A1 METHODS OF TREATING PROLIFERATIVE DISORDERS BIOMEDICINES, INC. (US) 2000-11-30 WO 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-20100267945-A1 AMINE DERIVATIVE HAVING NPY Y5 RECEPTOR ANTAGONISTIC ACTIVITY NPY5R, NPY1R, NPY2R AR 276/4885KIF11 3932/4885RAPGEF4 2709/4885

“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.