SCHEMBL24497305

SCHEMBL24497305

Cc1ccc(N)cc1Oc1cccc(C(F)(F)F)c1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TEAD1 P28347 3/20 0.53
MAPT P10636 4/20 0.51
L3MBTL1 Q9Y468 3/20 0.51
NPSR1 Q6W5P4 3/20 0.51
TSHR P16473 1/20 0.50
MAPK1 P28482 1/20 0.50
ALDH1A1 P00352 3/20 0.44
KDM4E B2RXH2 2/20 0.44
MAOB P27338 2/20 0.43
ADORA2A P29274 1/20 0.42
F10 P00742 1/20 0.42
POLB P06746 1/20 0.41
RAB9A P51151 1/20 0.41
ICAM1 P05362 1/20 0.40
SELE P16581 1/20 0.40
LMNA P02545 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
MCOLN3 Q8TDD5 1/20 0.40

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
SCHEMBL2748096 0.88 L3MBTL1 (0.55) TEAD1MAPTL3MBTL1NPSR1TSHR
SCHEMBL25472566 0.85 TEAD1 (0.55) TEAD1MAPTL3MBTL1NPSR1ALDH1A1
SCHEMBL2748407 0.84 L3MBTL1 (0.60) MAPTL3MBTL1NPSR1TSHRMAPK1
SCHEMBL22719531 0.82 TEAD1 (0.59) TEAD1MAPTL3MBTL1NPSR1ALDH1A1
SCHEMBL4608873 0.82 MAPT (0.55) TEAD1MAPTL3MBTL1NPSR1TSHR
SCHEMBL22732096 0.82 TEAD1 (0.58) TEAD1MAPTL3MBTL1NPSR1ALDH1A1
SCHEMBL2576322 0.81 MAPT (0.52) TEAD1MAPTL3MBTL1NPSR1TSHR
SCHEMBL29638122 0.79 EGFR (0.53) MAPTL3MBTL1NPSR1TSHRMAPK1
SCHEMBL2747848 0.79 EGFR (0.53) MAPTL3MBTL1NPSR1TSHRMAPK1
SCHEMBL6153537 0.79 TSHR (0.68) TEAD1MAPTL3MBTL1NPSR1TSHR

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-2022120354-A1 TEAD INHIBITORS AND USES THEREOF Ikena Oncology, Inc. (US) 2022-06-09 WO disclosed