SCHEMBL24501916

SCHEMBL24501916

CCC(C)c1ccc(Nc2ccc(S(=O)(=O)NC)cc2-c2cn(C)cn2)nc1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TEAD1 P28347 1/20 0.55
YAP1 P46937 1/20 0.55
TNNI3K Q59H18 12/20 0.40
BRAF P15056 6/20 0.40
MAPT P10636 1/20 0.34
GABRA1 P14867 1/20 0.34
GABRG2 P18507 1/20 0.34
GABRB3 P28472 1/20 0.34
GABRA5 P31644 1/20 0.34
GABRA3 P34903 1/20 0.34
GABRA2 P47869 1/20 0.34
KCNH2 Q12809 1/20 0.34
EGFR P00533 2/20 0.33
BRD4 O60885 1/20 0.32

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
SCHEMBL24496248 1.00 TEAD1 (0.55) TEAD1YAP1TNNI3KBRAFMAPT
SCHEMBL29648342 1.00 TEAD1 (0.55) TEAD1YAP1TNNI3KBRAFMAPT
SCHEMBL30828322 1.00 TEAD1 (0.55) TEAD1YAP1TNNI3KBRAFMAPT
SCHEMBL24496246 1.00 TEAD1 (0.55) TEAD1YAP1TNNI3KBRAFMAPT
SCHEMBL29648287 1.00 TEAD1 (0.55) TEAD1YAP1TNNI3KBRAFMAPT
SCHEMBL24496009 0.91 TEAD1 (0.58) TEAD1YAP1TNNI3KBRAFMAPT
SCHEMBL29648306 0.91 TEAD1 (0.58) TEAD1YAP1TNNI3KBRAFMAPT
SCHEMBL29648310 0.85 TEAD1 (0.58) TEAD1YAP1TNNI3KBRAFMAPT
SCHEMBL24496007 0.85 TEAD1 (0.58) TEAD1YAP1TNNI3KBRAFMAPT
SCHEMBL30828298 0.83 TEAD1 (0.57) TEAD1YAP1TNNI3KBRAFMAPT

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-2022120355-A1 TEAD DEGRADERS AND USES THEREOF Ikena Oncology, Inc. (US) 2022-06-09 WO disclosed