SCHEMBL23577237

SCHEMBL23577237

CN(c1cccc(-c2ccc(OCC(F)(F)F)nc2)c1)c1nc2nncn2c2cc(Cl)c(F)cc12

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
RECQL P46063 1/20 0.34
SCN9A Q15858 3/20 0.33
FGFR3 P22607 1/20 0.32
KDR P35968 1/20 0.32
FYN P06241 1/20 0.32
HRH4 Q9H3N8 1/20 0.32
CYP1A2 P05177 1/20 0.31
ATM Q13315 2/20 0.31
ABCG2 Q9UNQ0 1/20 0.31
PTGES O14684 2/20 0.31
GRIN2B Q13224 2/20 0.30
SYK P43405 1/20 0.30
DGAT1 O75907 1/20 0.30

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
SCHEMBL23577595 0.91 FYN (0.33) FYNATMABCG2GRIN2B
SCHEMBL23577736 0.89 SCN9A (0.35) ALDH1A1RECQLSCN9AFGFR3KDR
SCHEMBL23577460 0.88 NT5E (0.34) ATMABCG2GRIN2B
SCHEMBL29909818 0.85 MAP4K4 (0.36) ATMABCG2
SCHEMBL23576626 0.85 MAP4K4 (0.36) ATMABCG2
SCHEMBL23601029 0.84 FNTA (0.34) SCN9AABCG2PTGESGRIN2B
SCHEMBL23601064 0.84 CYP1A2 (0.34) ALDH1A1RECQLSCN9AHRH4CYP1A2
SCHEMBL23578530 0.83 ABCG2 (0.33) ABCG2GRIN2B
SCHEMBL23577201 0.83 ABCG2 (0.35) ABCG2GRIN2BSYK
SCHEMBL29909700 0.83 ABCG2 (0.35) ABCG2GRIN2BSYK

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 ALDH1A1 4095/4885RECQL 2820/4885SCN9A 4747/4885

“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.