SCHEMBL25533294

SCHEMBL25533294

COC(=O)c1c(C)n(C)c(C)cc1=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.53
KMT2A Q03164 3/20 0.43
MEN1 O00255 1/20 0.43
CYP3A4 P08684 2/20 0.40
ACHE P22303 1/20 0.40
ALDH1A1 P00352 3/20 0.39
HPGD P15428 1/20 0.38
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA7 P43166 1/20 0.37
CA9 Q16790 1/20 0.37
CA14 Q9ULX7 1/20 0.37
MYC P01106 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
NGFR P08138 1/20 0.36
MAPK1 P28482 2/20 0.36
PKM P14618 1/20 0.36
CYP1A2 P05177 1/20 0.36

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
SCHEMBL25536924 0.80 KDM4E (0.40) KDM4EKMT2AMEN1CYP3A4ACHE
SCHEMBL11389408 0.79 ALDH1A1 (0.45) KMT2AMEN1CYP3A4ACHEALDH1A1
SCHEMBL25529111 0.79 KDM4E (0.44) KDM4EKMT2AMEN1CYP3A4ALDH1A1
SCHEMBL5528107 0.79 KDM4E (0.53) KDM4EKMT2AMEN1CYP3A4ACHE
SCHEMBL29868078 0.78 MAPT (0.38) KDM4EKMT2AACHEALDH1A1
SCHEMBL10460993 0.77 GABRA1 (0.52) KDM4EKMT2AMEN1ALDH1A1HPGD
SCHEMBL6971384 0.76 KDM4E (0.48) KDM4EKMT2AMEN1ALDH1A1HPGD
SCHEMBL29867989 0.75 KDM4E (0.68) KDM4EKMT2AMEN1CYP3A4ACHE
SCHEMBL8335042 0.74 MAPT (0.58) KDM4EKMT2AMEN1CYP3A4ALDH1A1
SCHEMBL29868349 0.74 ALDH1A1 (0.33) KDM4EALDH1A1

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-20230151003-A1 COMPOUNDS AND METHODS OF USE EXELIXIS INC (US) 2023-05-18 US disclosed
CN-115605478-A Compounds and methods of use 埃克塞里艾克西斯公司(US) 2023-01-13 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-20230151003-A1 COMPOUNDS AND METHODS OF USE PRKACB, PRKACA, PRKX KDM4E 3309/4885KMT2A 3083/4885MEN1 3817/4885

“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.