SCHEMBL25031389

SCHEMBL25031389

CCCCCc1ccccc1NC(C)C

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.47
NR1H2 P55055 1/20 0.40
NR1H3 Q13133 1/20 0.40
CYSLTR2 Q9NS75 6/20 0.39
CYSLTR1 Q9Y271 6/20 0.39
ALOX5 P09917 1/20 0.39
PTGS2 P35354 1/20 0.39
HTR2A P28223 1/20 0.38
BID P55957 3/20 0.37
MCL1 Q07820 3/20 0.37
BCL2L1 Q07817 2/20 0.37
BAK1 Q16611 2/20 0.37
POLB P06746 1/20 0.37
TLR8 Q9NR97 1/20 0.37
KAT8 Q9H7Z6 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
SCHEMBL9350709 0.98 LIPG (0.50) LIPGNR1H2NR1H3CYSLTR2CYSLTR1
SCHEMBL13689141 0.87 ADRA2B (0.42) POLB
SCHEMBL9192542 0.85 LIPG (0.47) LIPGNR1H2NR1H3CYSLTR2CYSLTR1
SCHEMBL25786683 0.83 LIPG (0.46) LIPGNR1H2NR1H3CYSLTR2CYSLTR1
SCHEMBL9184469 0.83 LIPG (0.46) LIPGNR1H2NR1H3CYSLTR2CYSLTR1
SCHEMBL14191957 0.83 TDP1 (0.47) LIPGNR1H2NR1H3CYSLTR2CYSLTR1
SCHEMBL31390779 0.83 TDP1 (0.47) LIPGNR1H2NR1H3CYSLTR2CYSLTR1
SCHEMBL10408189 0.82 LIPG (0.41) LIPGNR1H2NR1H3CYSLTR2CYSLTR1
SCHEMBL28108556 0.82 IDO1 (0.40)
SCHEMBL9187793 0.81 LIPG (0.40) LIPGCYSLTR2CYSLTR1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230046340-A1 DIACYLGLYERCOL KINASE MODULATING COMPOUNDS GILEAD SCIENCES, INC. 2023-02-16 US 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-20230046340-A1 DIACYLGLYERCOL KINASE MODULATING COMPOUNDS DGKG, DGKB, DGKK LIPG 217/4885NR1H2 452/4885NR1H3 335/4885

“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.