SCHEMBL24734667

SCHEMBL24734667

CNN1CCCC(O)CC1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.39
GPR119 Q8TDV5 1/20 0.33
HSD11B1 P28845 1/20 0.32
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 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
SCHEMBL24789576 1.00 TSHR (0.39) TSHRGPR119HSD11B1CA12CA1
SCHEMBL12819844 0.91
SCHEMBL1283795 0.82
SCHEMBL1832028 0.76
SCHEMBL25710780 0.76
SCHEMBL24271569 0.74 CARM1 (0.39)
SCHEMBL22253855 0.71 ALDH1A1 (0.40)
SCHEMBL790781 0.71
SCHEMBL15388363 0.71
SCHEMBL528887 0.71

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022256459-A1 KRAS MODULATORS AND USES THEREOF QUANTA THERAPEUTICS, INC. (US) 2022-12-08 WO disclosed