SCHEMBL29149358

SCHEMBL29149358

O=C1CCC(C(=O)Nc2cc(Oc3ccc(C(F)(F)F)cn3)cc3c2OCC3)CN1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 11/20 0.49
FAAH O00519 5/20 0.45
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
POLB P06746 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
SCN10A Q9Y5Y9 3/20 0.43
SCN7A Q01118 1/20 0.42
KCNH2 Q12809 1/20 0.42
SCN5A Q14524 1/20 0.42
FPR2 P25090 1/20 0.39
BRAF P15056 2/20 0.39
KDR P35968 2/20 0.39
SLC5A1 P13866 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
SCHEMBL29149483 0.89 SCN9A (0.49) SCN9AFAAHMEN1LMNAPOLB
SCHEMBL29149194 0.83 SCN9A (0.40) SCN9AFAAHMEN1LMNAPOLB
SCHEMBL29149600 0.83 SCN9A (0.41) SCN9AFAAHLMNASCN10ASCN7A
SCHEMBL29149226 0.83 SCN9A (0.41) SCN9AFAAHLMNASCN10ASCN7A
SCHEMBL29149319 0.83 SCN9A (0.41) SCN9AFAAHLMNASCN10ASCN7A
SCHEMBL29149196 0.81 SCN9A (0.39) SCN9AFAAHLMNASCN10ASCN7A
SCHEMBL29149252 0.80 CNR1 (0.43) SCN9AFAAHMEN1LMNAPOLB
SCHEMBL29149270 0.80 CNR1 (0.43) SCN9AFAAHMEN1LMNAPOLB
SCHEMBL29149249 0.80 CNR1 (0.43) SCN9AFAAHMEN1LMNAPOLB
SCHEMBL29149231 0.80 CNR1 (0.42) SCN9AFAAHMEN1LMNAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4323338-A1 TEAD INHIBITORS Orion Corporation (FI) 2024-02-21 EP disclosed
CN-117500786-A TEAD inhibitors 奥赖恩公司 2024-02-02 CN disclosed
WO-2022219246-A1 TEAD INHIBITORS ORION CORPORATION (FI) 2022-10-20 WO disclosed