SCHEMBL20344793

SCHEMBL20344793

CCCN1C(=O)CC(C)c2cc(NS(=O)(=O)Cc3c(F)c(F)c(C)c(F)c3F)ccc21

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 8/20 0.32
ALDH1A1 P00352 3/20 0.32
HPGD P15428 2/20 0.32
KDM4E B2RXH2 1/20 0.32
HSD17B10 Q99714 1/20 0.32
HTR1A P08908 1/20 0.32
HTR7 P34969 1/20 0.32
CYP19A1 P11511 1/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
LMNA P02545 1/20 0.31
HTT P42858 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30
BRPF1 P55201 1/20 0.30
ADRA2A P08913 1/20 0.30
RXRA P19793 1/20 0.30

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
SCHEMBL20616508 0.83 BRD4 (0.32) BRD4ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL20344796 0.83
SCHEMBL20616482 0.83 NR3C2 (0.35) BRD4ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL20344739 0.81 BRD4 (0.42) BRD4ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL29424983 0.81 BRD4 (0.42) BRD4ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL20616505 0.80 BRD4 (0.32) BRD4ALDH1A1ADRA2A
SCHEMBL20616497 0.80 BRD4 (0.33) BRD4ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL20616506 0.79 NR3C1 (0.34) BRD4ALDH1A1HPGDMEN1KMT2A
SCHEMBL20344735 0.79 RXRA (0.36) BRD4ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL23709382 0.79 ALDH1A1 (0.31) BRD4ALDH1A1CYP1A2CYP3A4CYP2D6

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 1887/4885ALDH1A1 2410/4885HPGD 2474/4885

“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.