SCHEMBL24501728

SCHEMBL24501728

Cn1cnc(-c2cc(S(N)(=O)=O)ccc2Nc2ccc(C(F)(F)F)cn2)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TEAD1 P28347 3/20 0.61
▸ YAP1 P46937 1/20 0.61
▸ KDM4E B2RXH2 2/20 0.46
▸ GAA P10253 1/20 0.46
▸ TLR2 O60603 2/20 0.41
▸ TLR1 Q15399 2/20 0.41
▸ TSHR P16473 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ TNNI3K Q59H18 1/20 0.39
▸ CA12 O43570 3/20 0.38
▸ CA1 P00915 3/20 0.38
▸ CA2 P00918 3/20 0.38
▸ CA9 Q16790 3/20 0.38
▸ MAPT P10636 2/20 0.38
▸ CHRNA7 P36544 1/20 0.38
▸ MAPK10 P53779 1/20 0.38
▸ CCNK O75909 1/20 0.37
▸ CCNA2 P20248 1/20 0.37
▸ CDK2 P24941 1/20 0.37
▸ CDK12 Q9NYV4 1/20 0.37

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
SCHEMBL24501068 0.90 TEAD1 (0.61) TEAD1YAP1KDM4EGAATLR2
SCHEMBL22718190 0.89 TEAD1 (0.77) TEAD1YAP1TLR2TLR1TSHR
SCHEMBL29438880 0.89 TEAD1 (0.77) TEAD1YAP1TLR2TLR1TSHR
SCHEMBL24501692 0.88 TEAD1 (0.59) TEAD1YAP1KDM4EGAATLR2
SCHEMBL22718325 0.87 TEAD1 (0.62) TEAD1YAP1KDM4ETLR2TLR1
SCHEMBL29438868 0.87 TEAD1 (0.62) TEAD1YAP1KDM4ETLR2TLR1
SCHEMBL22718322 0.86 TEAD1 (0.58) TEAD1YAP1KDM4EGAATLR2
SCHEMBL24497427 0.84 TEAD1 (0.50) TEAD1YAP1TSHRL3MBTL1MAPK10
SCHEMBL29648357 0.84 TEAD1 (0.50) TEAD1YAP1TSHRL3MBTL1MAPK10
SCHEMBL22843430 0.84 TEAD1 (0.54) TEAD1YAP1KDM4EGAATLR2

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