SCHEMBL21733830

SCHEMBL21733830

COc1ccc(CN(Cc2ccc(OC)cc2)c2cc(C)c(C(F)(F)F)c(C3Cc4nc(S(C)(=O)=O)nc(N5CCN(C(=O)OC(C)(C)C)CC5)c4CC3C)n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 10/20 0.38
TLR9 Q9NR96 3/20 0.36
KRAS P01116 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TLR7 Q9NYK1 1/20 0.34
BMP1 P13497 1/20 0.34
EPHX2 P34913 1/20 0.34
SLC2A1 P11166 2/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 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
SCHEMBL21733788 0.92 KRAS (0.44) GPR119KRASMAPT
SCHEMBL21734026 0.89 TLR9 (0.36) GPR119TLR9KRASLMNAMAPT
SCHEMBL30512389 0.88 NR1H2 (0.35) GPR119KRAS
SCHEMBL25378466 0.88 NR1H2 (0.35) GPR119KRAS
SCHEMBL25378472 0.88 NR1H2 (0.35) GPR119KRAS
SCHEMBL24854453 0.88 GPR119 (0.37) GPR119TLR9KRASLMNAMAPT
SCHEMBL21733474 0.87 KRAS (0.43) GPR119KRASMAPT
SCHEMBL30177863 0.87 KRAS (0.43) GPR119KRASMAPT
SCHEMBL30708356 0.87 JAK2 (0.35) GPR119KRASBMP1EPHX2SLC2A1
SCHEMBL30708428 0.86 GPR119 (0.34) GPR119KRASEPHX2SLC2A1

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-11760744-B2 Fused ring compounds GENENTECH, INC. (US) 2023-09-19 US disclosed
US-11760744-B2 Fused ring compounds GENENTECH, INC. (US) 2023-09-19 US disclosed
WO-2020035031-A1 FUSED RING COMPOUNDS GENENTECH, INC. (US) 2020-02-20 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-11760744-B2 Fused ring compounds KRAS, NRAS, HRAS GPR119 1771/4885TLR9 4814/4885KRAS 1/4885

“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.