SCHEMBL24975414

SCHEMBL24975414

COC(=O)c1ccc(-c2ccc(NC(C)C)c(C)c2)nc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SPR P35270 1/20 0.45
MAPK1 P28482 2/20 0.45
KDM4E B2RXH2 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
HSD17B1 P14061 1/20 0.42
HSD17B2 P37059 1/20 0.42
HPGDS O60760 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
POLB P06746 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
SLC2A1 P11166 1/20 0.40
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HCAR3 P49019 1/20 0.38
ROCK2 O75116 2/20 0.37
PRKG1 Q13976 2/20 0.37
PRKACA P17612 1/20 0.37
PRKACG P22612 1/20 0.37

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
SCHEMBL29854306 1.00 SPR (0.45) SPRMAPK1KDM4EL3MBTL1HSD17B1
SCHEMBL29801107 1.00 SPR (0.45) SPRMAPK1KDM4EL3MBTL1HSD17B1
SCHEMBL29854329 0.87 MAPK1 (0.43) SPRMAPK1KDM4EL3MBTL1HPGDS
SCHEMBL24975201 0.87 MAPK1 (0.43) SPRMAPK1KDM4EL3MBTL1HPGDS
SCHEMBL29801048 0.87 MAPK1 (0.43) SPRMAPK1KDM4EL3MBTL1HPGDS
SCHEMBL29854299 0.86 MAPK1 (0.48) SPRMAPK1KDM4EL3MBTL1HSD17B1
SCHEMBL24976761 0.86 MAPK1 (0.48) SPRMAPK1KDM4EL3MBTL1HSD17B1
SCHEMBL29801088 0.86 MAPK1 (0.48) SPRMAPK1KDM4EL3MBTL1HSD17B1
SCHEMBL29854271 0.81 POLB (0.43) SPRMAPK1KDM4EL3MBTL1HSD17B1
SCHEMBL23063966 0.81 HTT (0.46) SPRMAPK1KDM4EL3MBTL1HSD17B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230023124-A1 CANCER TREATMENTS TARGETING CANCER STEM CELLS REMEDY PLAN, INC. (US) 2023-01-26 US disclosed
CN-114929672-A Cancer therapy targeting cancer stem cells 治疗方案股份有限公司 2022-08-19 CN 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-20230023124-A1 CANCER TREATMENTS TARGETING CANCER STEM CELLS MCL1, KIT, GLI1 SPR 3833/4885MAPK1 3430/4885KDM4E 1184/4885

“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.