SCHEMBL20344747

SCHEMBL20344747

CCCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cc(F)c(C)c(F)c3)ccc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 4/20 0.42
CREBBP Q92793 2/20 0.42
TRIM24 O15164 4/20 0.40
CES2 O00748 1/20 0.38
ATAD2 Q6PL18 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
HDAC1 Q13547 2/20 0.37
HDAC8 Q9BY41 2/20 0.37
HDAC6 Q9UBN7 2/20 0.37
CHRM1 P11229 2/20 0.36
CYP1A2 P05177 1/20 0.35
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
CHRM5 P08912 1/20 0.34
DRD2 P14416 1/20 0.34
CHRM3 P20309 1/20 0.34
DRD4 P21917 1/20 0.34

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
SCHEMBL20344751 0.90 BRD4 (0.41) BRD4CREBBPTRIM24CES2ATAD2
SCHEMBL15298954 0.86 BRD4 (0.44) BRD4CREBBPTRIM24ATAD2KMT2A
SCHEMBL29424983 0.86 BRD4 (0.42) BRD4CREBBPTRIM24CES2ATAD2
SCHEMBL20344739 0.86 BRD4 (0.42) BRD4CREBBPTRIM24CES2ATAD2
SCHEMBL20344767 0.85 BRD4 (0.37) BRD4CREBBPTRIM24CES2ATAD2
SCHEMBL20616463 0.85 BRD4 (0.40) BRD4HDAC1HDAC8HDAC6BRPF1
SCHEMBL20616478 0.84 BRD4 (0.37) BRD4KMT2AHDAC1HDAC8HDAC6
SCHEMBL20616476 0.84 BRD4 (0.37) BRD4CREBBPTRIM24KMT2AHDAC1
SCHEMBL20344748 0.84 BRD4 (0.41) BRD4CREBBPTRIM24CES2ATAD2
SCHEMBL30803804 0.84 BRD4 (0.41) BRD4CREBBPTRIM24CES2ATAD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3342766-B1 SMALL MOLECULE COMPOUND FOR ENHANCING PLANT STRESS RESISTANCE CAS CENTER FOR EXCELLENCE IN MOLECULAR PLANT SCIENCES (CN) 2020-12-09 EP disclosed
US-10842151-B2 Small molecule compound for enhancing plant stress resistance CAS CENTER FOR EXCELLENCE IN MOLECULAR PLANT SCIENCES (CN) 2020-11-24 US disclosed
EP-3342766-A1 SMALL MOLECULE COMPOUND FOR ENHANCING PLANT STRESS RESISTANCE Shanghai Institutes for Biological Sciences, Chinese Academy of Sciences (CN) 2018-07-04 EP 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-10842151-B2 Small molecule compound for enhancing plant stress resistance CYP4F11, RICTOR, MYB BRD4 1887/4885CREBBP 100/4885TRIM24 4017/4885

“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.