SCHEMBL4928575

SCHEMBL4928575

COC(=O)c1cc(Cl)cc(N2CCN(C(=O)OC(C)(C)C)CC2)c1OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.46
HSD17B10 Q99714 1/20 0.46
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
SMARCA2 P51531 1/20 0.43
SMARCA4 P51532 1/20 0.43
PBRM1 Q86U86 1/20 0.43
STS P08842 3/20 0.43
EED O75530 1/20 0.43
RBBP4 Q09028 1/20 0.43
SUZ12 Q15022 1/20 0.43
EZH2 Q15910 1/20 0.43
AEBP2 Q6ZN18 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
NR1H2 P55055 1/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
SUV39H2 Q9H5I1 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
SCHEMBL4933219 0.89 MEN1 (0.44) MAPK1HSD17B10MEN1KMT2ASMARCA2
SCHEMBL4930750 0.84 SUV39H2 (0.47) MEN1KMT2ASTSHTTSMN1; SMN2
SCHEMBL654933 0.83 MEN1 (0.51) MAPK1MEN1KMT2ASMARCA2SMARCA4
SCHEMBL4933535 0.82 MAPT (0.44) MAPK1HSD17B10STSHTTSMN1; SMN2
SCHEMBL4931500 0.81 MEN1 (0.44) MEN1KMT2ASMARCA2SMARCA4PBRM1
SCHEMBL4927499 0.81 MAPT (0.42) MEN1KMT2ASTSHTTSMN1; SMN2
SCHEMBL12316351 0.79 GAA (0.47) MEN1KMT2ASTSSMN1; SMN2LMNA
SCHEMBL7352143 0.78 KMT2A (0.52) KMT2ASMARCA2SMARCA4PBRM1EED
SCHEMBL23456158 0.77 SMN1; SMN2 (0.53) MEN1KMT2ASTSHTTSMN1; SMN2
SCHEMBL20516391 0.76 POLB (0.51) MEN1KMT2ASMARCA2SMARCA4PBRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8076338-B2 Such as 6-(4-phenylpiperazin-1-yl)-9H-purine; cell proliferation/differentiation EXELIXIS, INC. (US) 2011-12-13 US disclosed
US-20080076774-A1 Kinase Modulators and Methods of Use EXELIXIS, INC. (US) 2008-03-27 US disclosed
EP-1750727-A2 KINASE MODULATORS AND METHODS OF USE Exelixis, Inc. (US) 2007-02-14 EP disclosed
WO-2005117909-A2 KINASE MODULATORS AND METHODS OF USE EXELIXIS, INC. (US) 2005-12-15 WO 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-20080076774-A1 Kinase Modulators and Methods of Use AKT3, RPS6KA3, CDK3 MAPK1 34/4885HSD17B10 4375/4885MEN1 2030/4885

“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.