SCHEMBL13424932

SCHEMBL13424932

[C-]#[N+]c1ccc(C(=O)Nc2cc(C(=O)Nc3c(C)cc(C(F)(C(F)(F)F)C(F)(F)F)cc3C)ccc2C#N)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 4/20 0.36
HDAC8 Q9BY41 2/20 0.36
HDAC6 Q9UBN7 2/20 0.36
BRAF P15056 1/20 0.35
GAA P10253 2/20 0.34
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
KMT2A Q03164 2/20 0.34
PDE5A O76074 1/20 0.34
PDE1A P54750 1/20 0.34
PDE1B Q01064 1/20 0.34
PDE1C Q14123 1/20 0.34
ALDH1A1 P00352 3/20 0.33
KDM4E B2RXH2 2/20 0.33
MEN1 O00255 1/20 0.33
HPGD P15428 1/20 0.33
LMNA P02545 1/20 0.33
PKM P14618 1/20 0.33
MAPK14 Q16539 2/20 0.33
AR P10275 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
SCHEMBL13456091 0.88 RXFP1 (0.43) BRAFGAANPC1RAB9AKMT2A
SCHEMBL3224751 0.84 PKM (0.38) BRAFGAANPC1RAB9AKMT2A
SCHEMBL3205565 0.82 LMNA (0.36) BRAFGAANPC1RAB9AKMT2A
SCHEMBL13424940 0.82 BCHE (0.40) HDAC8HDAC6KDM4EMAPK14RXFP1
SCHEMBL13424935 0.82 TRPV1 (0.41) GAANPC1RAB9AKMT2AALDH1A1
SCHEMBL11986866 0.80 NLRP3 (0.36) BRAFGAANPC1RAB9APDE5A
SCHEMBL3011716 0.79 LCK (0.41) HDAC1BRAFGAAPKMAR
SCHEMBL289051 0.78 RXFP1 (0.39) BRAFGAANPC1RAB9AKMT2A
SCHEMBL3210249 0.76 MAPT (0.44) BRAFGAANPC1RAB9AKMT2A
SCHEMBL29360338 0.76 KMT2A (0.40) GAAKMT2AALDH1A1KDM4EMEN1

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-8389766-B2 Insecticidal compounds SYNGENTA CROP PROTECTION LLC (US) 2013-03-05 US disclosed
US-20100056639-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2010-03-04 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-20100056639-A1 INSECTICIDAL COMPOUNDS ACHE, CHRM1, NIT2 HDAC1 234/4885HDAC8 2132/4885HDAC6 51/4885

“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.