SCHEMBL31318537

SCHEMBL31318537

COc1c(Cl)cc(C(=O)N2CC3(CC3)S(=O)(=O)c3ccccc32)cc1Cl

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 6/20 0.53
CYP2C9 P11712 1/20 0.49
ABCG2 Q9UNQ0 1/20 0.49
LMNA P02545 2/20 0.39
TAS1R3 Q7RTX0 1/20 0.38
TAS1R1 Q7RTX1 1/20 0.38
TAS1R2 Q8TE23 1/20 0.38
TUBB4A P04350 1/20 0.37
TUBB P07437 1/20 0.37
TUBA3C P0DPH7 1/20 0.37
TUBA1B P68363 1/20 0.37
TUBA4A P68366 1/20 0.37
TUBB4B P68371 1/20 0.37
TUBB3 Q13509 1/20 0.37
TUBB2A Q13885 1/20 0.37
TUBB8 Q3ZCM7 1/20 0.37
TUBA3E Q6PEY2 1/20 0.37
TUBA1A Q71U36 1/20 0.37
TUBA1C Q9BQE3 1/20 0.37
TUBB6 Q9BUF5 1/20 0.37

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
SCHEMBL31318559 0.87 SLC22A12 (0.43) SLC22A12CYP2C9ABCG2LMNATUBB4A
SCHEMBL31318553 0.86 SLC22A12 (0.66) SLC22A12CYP2C9ABCG2HSD11B1
SCHEMBL10322864 0.81 SLC22A12 (0.76) SLC22A12CYP2C9ABCG2LMNATAS1R3
SCHEMBL31318511 0.77 SLC22A12 (0.47) SLC22A12CYP2C9ABCG2ALDH1A1MEN1
SCHEMBL31318510 0.76 SLC22A12 (0.41) SLC22A12CYP2C9ABCG2LMNATAS1R3
SCHEMBL31318517 0.76 SIRT3 (0.41) SLC22A12CYP2C9ABCG2LMNATAS1R3
SCHEMBL10323009 0.75 SLC22A12 (0.69) SLC22A12CYP2C9ABCG2LMNATAS1R3
SCHEMBL10323032 0.75 SLC22A12 (0.72) SLC22A12CYP2C9ABCG2LMNATUBB4A
SCHEMBL31318549 0.74 SLC22A12 (0.39) SLC22A12CYP2C9ABCG2LMNATAS1R3
SCHEMBL10322430 0.73 SLC22A12 (0.76) SLC22A12CYP2C9ABCG2LMNATAS1R3

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