SCHEMBL29937112

SCHEMBL29937112

Cc1cc2c(c(I)nn2C2CCCCO2)c(Br)c1C(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.34
CYP4A11 Q02928 2/20 0.34
RET P07949 4/20 0.33
ATR Q13535 1/20 0.31
GAA P10253 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
SCHEMBL31243076 0.89 GAA (0.37) CYP4F2CYP4A11RETATRGAA
SCHEMBL30699417 0.85 RET (0.33) CYP4F2CYP4A11RETATR
SCHEMBL24802947 0.84 CYP4F2 (0.36) CYP4F2CYP4A11RETATRGAA
SCHEMBL28484352 0.80 CYP4F2 (0.38) CYP4F2CYP4A11RETATRGAA
SCHEMBL30300121 0.80 CYP4F2 (0.38) CYP4F2CYP4A11RETATRGAA
SCHEMBL29936966 0.79 RET (0.35) CYP4F2CYP4A11RETGAA
SCHEMBL26404733 0.79 RET (0.35) CYP4F2CYP4A11RETGAA
SCHEMBL31393084 0.79 CYP4F2 (0.32) CYP4F2CYP4A11RET
SCHEMBL20974775 0.79 CYP4F2 (0.40) CYP4F2CYP4A11RETATR
SCHEMBL31393242 0.77 RET (0.35) CYP4F2CYP4A11RETATR

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
EP-4713330-A1 TRICYCLIC COMPOUNDS AND USES THEREOF HUTCHMED Limited (CN) 2026-03-25 EP disclosed
WO-2024235286-A1 TRICYCLIC COMPOUNDS AND USES THEREOF HUTCHMED LIMITED (CN) 2024-11-21 WO disclosed
EP-4322954-A1 SMALL MOLECULE INHIBITORS OF KRAS G12D MUTANT Merck Sharp & Dohme LLC (US) 2024-02-21 EP disclosed
WO-2022221739-A1 SMALL MOLECULE INHIBITORS OF KRAS G12D MUTANT MERCK SHARP & DOHME CORP. (US) 2022-10-20 WO disclosed