SCHEMBL31318535

SCHEMBL31318535

COc1c(F)cc(C(=O)N2CC3(CC3)Oc3ccncc32)cc1Cl

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 3/20 0.38
SLC22A6 Q4U2R8 1/20 0.38
SLC22A8 Q8TCC7 1/20 0.38
MEN1 O00255 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
CHUK O15111 1/20 0.30
ROCK2 O75116 1/20 0.30
HTR1A P08908 1/20 0.30
ACLY P53396 1/20 0.30

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
SCHEMBL31318501 0.93 SLC22A12 (0.41) SLC22A12SLC22A6SLC22A8MEN1RAB9A
SCHEMBL31318558 0.93 SLC22A6 (0.41) SLC22A12SLC22A6SLC22A8ROCK2
SCHEMBL31318541 0.89 SLC22A12 (0.46) SLC22A12SLC22A6SLC22A8MEN1RAB9A
SCHEMBL31318515 0.87 SLC22A12 (0.44) SLC22A12SLC22A6SLC22A8HTR1AACLY
SCHEMBL31318528 0.86 SLC22A6 (0.36) SLC22A12SLC22A6SLC22A8MEN1KMT2A
SCHEMBL31318505 0.84 SLC22A6 (0.50) SLC22A12SLC22A6SLC22A8MEN1KMT2A
SCHEMBL31318506 0.83 SLC22A12 (0.48) SLC22A12SLC22A6SLC22A8ROCK2
SCHEMBL31318557 0.83 SLC22A12 (0.48) SLC22A12SLC22A6SLC22A8
SCHEMBL31318517 0.79 SIRT3 (0.41) SLC22A12MEN1KMT2A
SCHEMBL31318544 0.79 SIRT3 (0.41) SLC22A12MEN1KMT2A

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-119059989-A URAT1 inhibitor, preparation method and application thereof 中国药科大学 2024-12-03 CN disclosed