SCHEMBL30774249

SCHEMBL30774249

COc1ccc2c(Cl)c(C#N)c(Cl)nc2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.58
ALDH1A1 P00352 5/20 0.44
HPGDS O60760 1/20 0.44
GFER P55789 1/20 0.44
MAPT P10636 3/20 0.44
CDK2 P24941 1/20 0.44
CLK1 P49759 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
NQO1 P15559 1/20 0.44
L3MBTL1 Q9Y468 3/20 0.44
HPGD P15428 2/20 0.44
TSHR P16473 2/20 0.44
HBB P68871 1/20 0.44
HSD17B10 Q99714 1/20 0.44
ABCC8 Q09428 1/20 0.43
KCNJ11 Q14654 1/20 0.43
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
POLB P06746 2/20 0.43
MAPK1 P28482 2/20 0.41

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
SCHEMBL24373484 1.00 KDM4E (0.58) KDM4EALDH1A1HPGDSGFERMAPT
SCHEMBL19889997 0.87 KDM4E (0.56) KDM4EALDH1A1HPGDSMAPTCDK2
SCHEMBL14916907 0.81 KDM4E (0.54) KDM4EALDH1A1MAPTCDK2CLK1
SCHEMBL8488859 0.80 KDM4E (0.50) KDM4EALDH1A1HPGDSMAPTCDK2
SCHEMBL12068390 0.79 KDM4E (0.87) KDM4EALDH1A1HPGDSMAPTCDK2
SCHEMBL27096243 0.78 ALDH1A1 (0.49) KDM4EALDH1A1GFERMAPTCLK1
SCHEMBL24578779 0.77 MDM4 (0.40) KDM4EALDH1A1MAPTL3MBTL1HPGD
SCHEMBL2125467 0.77 MDM4 (0.40) KDM4EALDH1A1NPSR1L3MBTL1HPGD
SCHEMBL19889941 0.75 KDM4E (0.60) KDM4EALDH1A1MAPTCDK2CLK1
SCHEMBL6382801 0.73 SRC (0.60) KDM4EHPGDSSRC

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-20240059703-A1 HETEROCYCLIC SPIRO COMPOUNDS AND METHODS OF USE AMGEN INC. 2024-02-22 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-20240059703-A1 HETEROCYCLIC SPIRO COMPOUNDS AND METHODS OF USE KRAS, HRAS, APC KDM4E 4694/4885ALDH1A1 1221/4885HPGDS 160/4885

“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.