SCHEMBL13697333

SCHEMBL13697333

Cc1cc(F)c(-c2c(Cl)nnc(C)c2-c2ccc(Cl)cc2)c(F)c1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
RAPGEF4 Q8WZA2 3/20 0.35
MAPT P10636 3/20 0.35
ALDH1A1 P00352 2/20 0.34
HTT P42858 1/20 0.34
HSD17B10 Q99714 2/20 0.33
IKBKB O14920 1/20 0.33
MAP3K14 Q99558 1/20 0.33
CYP1A2 P05177 1/20 0.33
MAPK1 P28482 1/20 0.33
KDM4E B2RXH2 1/20 0.33
RAB9A P51151 2/20 0.33
PTGS2 P35354 1/20 0.33
NPC1 O15118 1/20 0.33
TP53 P04637 1/20 0.33
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PSD A5PKW4 1/20 0.32

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
SCHEMBL2356139 0.94 MEN1 (0.36) MEN1KMT2AMAPTALDH1A1HTT
SCHEMBL10026448 0.92 KDR (0.33) MEN1KMT2ARAPGEF4MAPTALDH1A1
SCHEMBL1869939 0.91 RAB9A (0.36) MEN1KMT2ARAPGEF4MAPTALDH1A1
SCHEMBL2848598 0.88 ESR1 (0.37) MEN1KMT2AMAPTALDH1A1HTT
SCHEMBL2349573 0.88 KMT2A (0.38) MEN1KMT2AMAPTALDH1A1HTT
SCHEMBL14962991 0.88 MAOB (0.40) MEN1KMT2AMAPTALDH1A1CYP1A2
SCHEMBL69222 0.86 NPC1 (0.44) MEN1KMT2AHSD17B10IKBKBMAP3K14
SCHEMBL29369509 0.86 NPC1 (0.44) MEN1KMT2AHSD17B10IKBKBMAP3K14
SCHEMBL2354029 0.86 MEN1 (0.43) MEN1KMT2AMAPTHSD17B10CYP1A2
SCHEMBL1873945 0.85 KMT2A (0.34) MEN1KMT2ARAPGEF4MAPTALDH1A1

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-20090221588-A1 FUNGICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION, INC. (US) 2009-09-03 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-20090221588-A1 FUNGICIDAL COMPOSITIONS TUBB2B, TUBB, TUBB4B MEN1 1901/4885KMT2A 1881/4885RAPGEF4 4293/4885

“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.