SCHEMBL23969823

SCHEMBL23969823

Cc1c(O)c(C(C)C)c(C)c(F)c1F

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 3/20 0.31
TAS1R1 Q7RTX1 3/20 0.31
TAS1R2 Q8TE23 3/20 0.31
BCL2 P10415 1/20 0.31
BCL2L1 Q07817 1/20 0.31
MCL1 Q07820 1/20 0.31
BCL2L2 Q92843 1/20 0.31

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
SCHEMBL23848679 0.88
SCHEMBL24870544 0.88 TAS1R3 (0.31) TAS1R3TAS1R1TAS1R2
SCHEMBL24599551 0.83
SCHEMBL24599546 0.83 TAS1R3 (0.31) TAS1R3TAS1R1TAS1R2
SCHEMBL24870390 0.83 TAS1R3 (0.31) TAS1R3TAS1R1TAS1R2
SCHEMBL23867804 0.83 TAS1R3 (0.31) TAS1R3TAS1R1TAS1R2
SCHEMBL23867810 0.83 TAS1R3 (0.31) TAS1R3TAS1R1TAS1R2
SCHEMBL24462730 0.83 TAS1R3 (0.31) TAS1R3TAS1R1TAS1R2
SCHEMBL23867801 0.82 BCL2 (0.31) BCL2BCL2L1MCL1BCL2L2
SCHEMBL25504163 0.78 TAS1R3 (0.31) TAS1R3TAS1R1TAS1R2

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-11345701-B1 KRAS mutant protein inhibitors JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2022-05-31 US disclosed
US-11161847-B2 KRAS mutant protein inhibitors JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2021-11-02 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 (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-11161847-B2 KRAS mutant protein inhibitors KRAS, NRAS, APC TAS1R3 3356/4885TAS1R1 2848/4885TAS1R2 3400/4885
US-11345701-B1 KRAS mutant protein inhibitors KRAS, NRAS, APC TAS1R3 3356/4885TAS1R1 2848/4885TAS1R2 3400/4885

“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.