SCHEMBL23601332

SCHEMBL23601332

CN(c1cccc(Oc2cnc(CN3CCOCC3)cn2)c1)c1nc2nncn2c2cc(Cl)ccc12

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RXRB P28702 8/20 0.36
SLC2A1 P11166 2/20 0.32
KCNH2 Q12809 1/20 0.31
MCHR1 Q99705 2/20 0.31
FGFR1 P11362 1/20 0.30
FGFR4 P22455 1/20 0.30
KDR P35968 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
HTT P42858 1/20 0.30
CXCR4 P61073 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
SCHEMBL31229475 1.00 RXRB (0.36) RXRBSLC2A1KCNH2MCHR1FGFR1
SCHEMBL23601960 0.86 SLC6A2 (0.32)
SCHEMBL23577160 0.86 JAK2 (0.35) SLC2A1KCNH2MCHR1KDM4E
SCHEMBL29909278 0.83 RXRB (0.37) RXRBKDM4EALDH1A1HPGDHTT
SCHEMBL23601648 0.78 ALDH1A1 (0.38) SLC2A1MCHR1KDM4EALDH1A1HPGD
SCHEMBL23576730 0.77 AOC3 (0.39) KCNH2FGFR1KDR
SCHEMBL23577533 0.74 FGFR1 (0.39) KCNH2FGFR1KDR
SCHEMBL23577971 0.73 PDE2A (0.39) KDM4EALDH1A1HPGDHTT
SCHEMBL29909436 0.73 PDE2A (0.39) KDM4EALDH1A1HPGDHTT
SCHEMBL23601772 0.71 MAT2A (0.45) KDM4EALDH1A1HPGDHTT

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 RXRB 1016/4885SLC2A1 3296/4885KCNH2 4496/4885

“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.