SCHEMBL9609170

SCHEMBL9609170

Fc1cc(CCNc2ncnc3sccc23)cc(F)c1F

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTT P42858 5/20 0.61
LMNA P02545 3/20 0.61
SMN1; SMN2 Q16637 3/20 0.61
RAB9A P51151 3/20 0.61
NPC1 O15118 2/20 0.61
GALR3 O60755 1/20 0.61
NR2F2 P24468 1/20 0.61
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
TSHR P16473 1/20 0.49
TNF P01375 2/20 0.48
NOD1 Q9Y239 2/20 0.48
EGFR P00533 2/20 0.48
FADS1 O60427 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
SCHEMBL8516267 0.82 HTT (0.61) HTTLMNASMN1; SMN2RAB9ANPC1
SCHEMBL1904097 0.81 HTT (0.70) HTTLMNASMN1; SMN2RAB9ANPC1
SCHEMBL8498550 0.81 MEN1 (0.63) HTTLMNASMN1; SMN2RAB9ANPC1
SCHEMBL8498537 0.80 MEN1 (0.56) HTTLMNASMN1; SMN2RAB9ANPC1
SCHEMBL8506277 0.80 MEN1 (0.50) HTTLMNASMN1; SMN2RAB9ANPC1
SCHEMBL8482940 0.80 MEN1 (0.77) HTTLMNASMN1; SMN2RAB9ANPC1
SCHEMBL8490047 0.79 HTT (0.61) HTTLMNASMN1; SMN2RAB9ANPC1
SCHEMBL8505626 0.79 HTT (0.68) HTTLMNASMN1; SMN2RAB9ANPC1
SCHEMBL3966396 0.79 HTT (0.68) HTTLMNASMN1; SMN2RAB9ANPC1
SCHEMBL8483065 0.79 HTT (0.64) HTTLMNASMN1; SMN2RAB9ANPC1

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-20120136150-A1 4-(3-Butynyl)Aminopyrimidine Derivatives as Pest Control Agents for Agricultural and Horticultural Use SDS BIOTECH K.K. (JP) 2012-05-31 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-20120136150-A1 4-(3-Butynyl)Aminopyrimidine Derivatives as Pest Control Agents for Agricultural and Horticultural Use CBR3, CBR1, HRH2 HTT 2572/4885LMNA 4659/4885SMN1; SMN2 4679/4885

“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.