SCHEMBL20964640

SCHEMBL20964640

Cc1ccc(NC(=O)CC(C)C)c(Cl)c1

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.53
KMT2A Q03164 5/20 0.53
RAB9A P51151 5/20 0.52
KDM4E B2RXH2 4/20 0.52
TSHR P16473 1/20 0.51
NPC1 O15118 4/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
ALDH1A1 P00352 2/20 0.51
HPGD P15428 1/20 0.51
GAA P10253 2/20 0.50
HTT P42858 2/20 0.50
POLB P06746 2/20 0.48
HSD17B10 Q99714 1/20 0.48
TP53 P04637 1/20 0.48
LMNA P02545 1/20 0.48
MAPT P10636 1/20 0.48
ALOX12 P18054 1/20 0.48

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
SCHEMBL20964693 0.87 KDM4E (0.49) MEN1KMT2ARAB9AKDM4ENPC1
SCHEMBL9313923 0.85 MEN1 (0.68) MEN1KMT2ARAB9AKDM4ENPC1
SCHEMBL30022414 0.84 RAB9A (0.54) MEN1KMT2ARAB9AKDM4ENPC1
SCHEMBL7264600 0.82 ALDH1A1 (0.73) MEN1KMT2ARAB9AKDM4ENPC1
SCHEMBL10176583 0.82 MEN1 (0.59) MEN1KMT2ARAB9AKDM4ENPC1
SCHEMBL13018987 0.82 KDM4E (0.52) MEN1KMT2ARAB9AKDM4ETSHR
SCHEMBL31570084 0.81 MEN1 (0.57) MEN1KMT2ARAB9AKDM4ENPC1
SCHEMBL9292088 0.81 MEN1 (0.57) MEN1KMT2ARAB9AKDM4ENPC1
SCHEMBL23130363 0.80 RAB9A (0.53) MEN1KMT2ARAB9AKDM4ENPC1
SCHEMBL22722429 0.79 POLB (0.59) MEN1KMT2ARAB9AKDM4ENPC1

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-20190127361-A1 Therapeutic Compounds RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2019-05-02 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-20190127361-A1 Therapeutic Compounds SDHA, SLC10A1, SERPINC1 MEN1 179/4885KMT2A 4728/4885RAB9A 426/4885

“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.