SCHEMBL21733780

SCHEMBL21733780

Cc1ccc2cnn(C3CCCCO3)c2c1C1CCc2c(nc[nH]c2=O)C1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.35
CYP4A11 Q02928 2/20 0.35
RXRA P19793 1/20 0.33
RXRB P28702 1/20 0.33
RXRG P48443 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
KDM5B Q9UGL1 1/20 0.32
GRM7 Q14831 1/20 0.31
ATR Q13535 1/20 0.31
RET P07949 1/20 0.30
EZH2 Q15910 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
SCHEMBL30834498 1.00 CYP4F2 (0.35) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL21243918 0.86 GRM7 (0.41) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL21733778 0.80 CYP4F2 (0.38) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL30834515 0.80 CYP4F2 (0.38) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL21733779 0.80 KRAS (0.37) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL30834532 0.80 KRAS (0.37) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL21734020 0.80 GRM7 (0.33) GRM7
SCHEMBL30834537 0.75 KRAS (0.48)
SCHEMBL21733813 0.75 KRAS (0.48)
SCHEMBL21722170 0.74 ALDH1A1 (0.39) CYP4F2CYP4A11RXRARXRBRXRG

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 4 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
US-20230002345-A1 FUSED RING COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2023-01-05 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 (2 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 CYP4F2 813/4885CYP4A11 1657/4885RXRA 1930/4885
US-20230002345-A1 FUSED RING COMPOUNDS KRAS, NRAS, HRAS CYP4F2 813/4885CYP4A11 1657/4885RXRA 1930/4885

“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.