SCHEMBL23465657

SCHEMBL23465657

CC(F)(F)C(=O)CCCCCN

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PAOX Q6QHF9 2/20 0.52
▸ HDAC6 Q9UBN7 1/20 0.52
▸ MEN1 O00255 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ PLG P00747 1/20 0.48
▸ LMNA P02545 1/20 0.48
▸ THRB P10828 1/20 0.48
▸ ALOX15 P16050 1/20 0.48
▸ SLC6A2 P23975 1/20 0.48
▸ RECQL P46063 1/20 0.48
▸ SLC6A3 Q01959 1/20 0.48
▸ FAAH O00519 11/20 0.47
▸ CES1 P23141 7/20 0.47
▸ CES2 O00748 2/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ CYP2D6 P10635 1/20 0.44
▸ NFKB1 P19838 1/20 0.44
▸ BLM P54132 1/20 0.43

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
SCHEMBL13089653 0.82 PAOX (0.56) PAOXHDAC6MEN1KMT2AALDH1A1
SCHEMBL13893493 0.82 PAOX (0.56) PAOXHDAC6MEN1KMT2AALDH1A1
SCHEMBL13893494 0.82 PAOX (0.56) PAOXHDAC6MEN1KMT2AALDH1A1
SCHEMBL18350804 0.82 PAOX (0.56) PAOXHDAC6MEN1KMT2AALDH1A1
SCHEMBL16147987 0.80 FAAH (0.72) MEN1KMT2AALDH1A1FAAHCES1
Ammonia Solution, Strong SCHEMBL5367620 0.80 HDAC6 (0.69) PAOXHDAC6MEN1KMT2AALDH1A1
SCHEMBL19771702 0.80 PAOX (0.54) PAOXHDAC6MEN1KMT2AALDH1A1
SCHEMBL16187339 0.79 PAOX (0.52) PAOXHDAC6MEN1KMT2AALDH1A1
SCHEMBL18823290 0.77 PAOX (0.50) PAOXHDAC6MEN1KMT2AALDH1A1
SCHEMBL14865265 0.75 PAOX (0.48) PAOXHDAC6MEN1KMT2AALDH1A1

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-20210161144-A1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO DOW AGROSCIENCES LLC (US) 2021-06-03 — — 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-20210161144-A1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO ACHE, DDT, MLYCD PAOX 444/4885HDAC6 489/4885MEN1 1180/4885

“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.

Send feedback