SCHEMBL23601623

SCHEMBL23601623

CN(C)CCOc1ccc(-c2cccc(N(C)c3nc4nncn4c4cc(Cl)ccc34)c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ACHE P22303 4/20 0.43
BRAF P15056 3/20 0.36
KDM4E B2RXH2 1/20 0.35
LSS P48449 1/20 0.35
PTPN1 P18031 1/20 0.35
ESR1 P03372 1/20 0.35
MAOA P21397 1/20 0.34
HTT P42858 1/20 0.34
MAT2A P31153 1/20 0.34
KDR P35968 1/20 0.34
CHRNB2 P17787 1/20 0.34
CHRNA4 P43681 1/20 0.34
TNKS O95271 1/20 0.34

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
SCHEMBL29909398 0.88 TP53 (0.37) KDR
SCHEMBL23600785 0.88 TP53 (0.37) KDR
SCHEMBL29909768 0.88 FNTA (0.40) KDM4EHTTMAT2A
SCHEMBL23601235 0.88 FNTA (0.40) KDM4EHTTMAT2A
SCHEMBL30920925 0.86 TP53 (0.39) MAT2A
SCHEMBL23577190 0.85 MAT2A (0.37) KDM4EHTTMAT2A
SCHEMBL29909135 0.85 MAT2A (0.37) KDM4EHTTMAT2A
SCHEMBL23576935 0.84 FNTA (0.36) HTTMAT2A
SCHEMBL23577059 0.83 FNTA (0.41) MAT2A
SCHEMBL29909922 0.83 FNTA (0.41) MAT2A

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-20220324866-A1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS GILEAD SCIENCES, INC. 2022-10-13 US disclosed
WO-2021130638-A1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS CARNA BIOSCIENCES, INC. (JP) 2021-07-01 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-20220324866-A1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS DGKG, DGKB, DGKK ACHE 4227/4885BRAF 228/4885KDM4E 1748/4885

“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.