SCHEMBL29259161

SCHEMBL29259161

O=C(Nc1ccc(C(F)(F)F)cc1)C1CCCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1

nearest known ligand 0.86

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RHOA P61586 20/20 0.86
RHOC P08134 3/20 0.86

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
SCHEMBL29259533 0.93 RHOA (0.78) RHOARHOC
SCHEMBL1534209 0.93 RHOA (1.00) RHOARHOC
SCHEMBL30946673 0.89 RHOA (0.81) RHOARHOC
SCHEMBL29259139 0.88 RHOA (0.86) RHOARHOC
SCHEMBL29259147 0.86 RHOA (0.78) RHOARHOC
SCHEMBL12959501 0.86 RHOA (0.87) RHOARHOC
SCHEMBL21926847 0.86 RHOA (1.00) RHOARHOC
SCHEMBL12803500 0.86 RHOA (1.00) RHOARHOC
SCHEMBL29259126 0.86 RHOA (0.80) RHOARHOC
SCHEMBL29259128 0.84 RHOA (0.63) RHOARHOC

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
CN-118184572-A Preparation of novel HsClpP agonists and application thereof in anti-inflammatory and anti-tumor 四川大学 2024-06-14 CN disclosed