SCHEMBL23578331

SCHEMBL23578331

CCS(=O)(=O)c1ccc(-c2cccc(N(C)c3nc4nncn4c4cc(Cl)ccc34)c2)cc1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RORC P51449 3/20 0.37
CYP1A2 P05177 6/20 0.36
MAT2A P31153 4/20 0.36
PRMT5 O14744 2/20 0.36
CYP3A4 P08684 6/20 0.36
CYP2C9 P11712 5/20 0.36
CYP2C19 P33261 5/20 0.36
CYP2D6 P10635 3/20 0.36
HSD11B1 P28845 2/20 0.34
NR1I2 O75469 1/20 0.34
FNTA P49354 1/20 0.34
FNTB P49356 1/20 0.34
JAK2 O60674 1/20 0.34
TP53 P04637 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL23577050 0.92 RORC (0.37) RORCCYP1A2MAT2APRMT5CYP3A4
SCHEMBL29909502 0.92 RORC (0.37) RORCCYP1A2MAT2APRMT5CYP3A4
SCHEMBL23601032 0.91 RORC (0.40) RORCFNTAFNTB
SCHEMBL23601393 0.91 MAT2A (0.34) RORCCYP1A2MAT2APRMT5HSD11B1
SCHEMBL31229437 0.90 RORC (0.39) RORCFNTAFNTB
SCHEMBL31169425 0.90 ALDH1A1 (0.39) RORCCYP1A2MAT2APRMT5FNTA
SCHEMBL23601424 0.90 RORC (0.39) RORCFNTAFNTB
SCHEMBL23578155 0.90 ALDH1A1 (0.39) RORCCYP1A2MAT2APRMT5FNTA
SCHEMBL23601235 0.90 FNTA (0.40) CYP1A2MAT2APRMT5FNTAFNTB
SCHEMBL29909768 0.90 FNTA (0.40) CYP1A2MAT2APRMT5FNTAFNTB

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 3 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
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 RORC 1542/4885CYP1A2 4595/4885MAT2A 1551/4885

“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.