SCHEMBL23098372

SCHEMBL23098372

CSC(=O)NCCCC(C)=O

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.39
MAPK1 P28482 1/20 0.39
HIF1A Q16665 1/20 0.39
PAOX Q6QHF9 7/20 0.38
ALDH1A1 P00352 2/20 0.38
ACHE P22303 1/20 0.37
ADRA1A P35348 1/20 0.36
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CASP2 P42575 1/20 0.32
TSHR P16473 1/20 0.32
LMNA P02545 1/20 0.32
SLC15A2 Q16348 1/20 0.32

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
SCHEMBL16286199 0.78 ALDH1A1 (0.40) KDM4EMAPK1HIF1AALDH1A1MEN1
SCHEMBL1687734 0.77 KDM4E (0.67) KDM4EMAPK1HIF1APAOXALDH1A1
SCHEMBL19658369 0.77 KDM4E (0.46) KDM4EMAPK1HIF1APAOXALDH1A1
SCHEMBL10784050 0.76 EPHX1 (0.58) MEN1KMT2ACASP2
SCHEMBL854713 0.75 ADRA1A (0.45) KDM4EMAPK1HIF1APAOXALDH1A1
SCHEMBL19495294 0.74 PAOX (0.57) KDM4EMAPK1HIF1APAOXMEN1
SCHEMBL10963060 0.74 EPHX1 (0.61) ALDH1A1CASP2
SCHEMBL14990106 0.74 PAOX (0.43) KDM4EMAPK1HIF1APAOXACHE
SCHEMBL25477681 0.72 SMN1; SMN2 (0.36) KDM4EMAPK1HIF1AALDH1A1MEN1
SCHEMBL24388044 0.72

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-20210078983-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF CANCER Cellix Bio Provate Limited (IN) 2021-03-18 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-20210078983-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF CANCER SI, HBG2, HBG1 KDM4E 3790/4885MAPK1 3709/4885HIF1A 2498/4885

“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.