SCHEMBL30365136

SCHEMBL30365136

Nc1ccc2c(ccn2Cc2ccc(OC(F)(F)F)cc2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.50
GCGR P47871 1/20 0.48
PLAU P00749 2/20 0.45
PLG P00747 1/20 0.45
HDAC8 Q9BY41 2/20 0.44
HDAC6 Q9UBN7 2/20 0.44
HDAC11 Q96DB2 1/20 0.44
ABL1 P00519 1/20 0.43
BCR P11274 1/20 0.43
CACNA1H O95180 1/20 0.42
PRKCI P41743 1/20 0.42
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
HDAC3 O15379 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC10 Q969S8 1/20 0.41
KCNQ3 O43525 1/20 0.39
KCNQ2 O43526 1/20 0.39
KCNQ4 P56696 1/20 0.39

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
SCHEMBL23902736 1.00 HTR6 (0.50) HTR6GCGRPLAUPLGHDAC8
SCHEMBL30365128 0.86 PLAU (0.51) HTR6PLAUPLGPRKCIEPHX2
SCHEMBL3510208 0.86 PLAU (0.51) HTR6PLAUPLGPRKCIEPHX2
SCHEMBL2056298 0.84 GCGR (0.48) GCGRPLAUPLGHDAC8HDAC6
SCHEMBL15712272 0.83 HDAC8 (0.60) HTR6PLAUPLGHDAC8HDAC6
SCHEMBL31577316 0.82 KCNQ3 (0.55) HTR6PLAUPLGHDAC8HDAC6
SCHEMBL24855125 0.81 NPC1 (0.50) HTR6GCGRHDAC8HDAC6HDAC11
SCHEMBL30844613 0.81 NPC1 (0.50) HTR6GCGRHDAC8HDAC6HDAC11
SCHEMBL4939166 0.81 SCN9A (0.50) GCGRPLAUPLGHDAC8HDAC6
SCHEMBL6084878 0.81 HTR6 (0.59) HTR6GCGRPLAUHDAC8HDAC6

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
CN-115667216-B (1H-indol-5-yl) acrylamide derivatives as inhibitors of TEAD proteins and HIPPO-YAP1/TAZ signaling cascades for the treatment of cancer 赛诺菲 2025-02-18 CN disclosed
CN-115667216-A (1H-indol-5-yl) acrylamide derivatives as TEAD proteins and inhibitors of the HIPPO-YAP1/TAZ signaling cascade for the treatment of cancer 赛诺菲 2023-01-31 CN disclosed