SCHEMBL29059482

SCHEMBL29059482

CC(C)(CC(=O)F)C(F)F

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 1/20 0.31
CHRM1 P11229 1/20 0.31
TBXA2R P21731 1/20 0.31
ADRA1A P35348 1/20 0.31

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
SCHEMBL18762513 0.79 HMGCR (0.48) HMGCRCHRM1TBXA2RADRA1A
SCHEMBL5528664 0.77
SCHEMBL20908221 0.75 HMGCR (0.33) HMGCRCHRM1TBXA2RADRA1A
SCHEMBL28976503 0.72 PIK3CD (0.31)
SCHEMBL20908224 0.70 TET2 (0.33)
SCHEMBL19322192 0.69
SCHEMBL18762431 0.68 HDAC4 (0.30)
SCHEMBL19035618 0.65
SCHEMBL1991123 0.64
SCHEMBL25784732 0.64 GABRR1 (0.38)

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-116783204-A Modulators of cystic fibrosis transmembrane conductance regulator 弗特克斯药品有限公司 2023-09-19 CN disclosed
CN-116601158-A Modulators of cystic fibrosis transmembrane conductance regulator 弗特克斯药品有限公司 2023-08-15 CN disclosed