SCHEMBL31318501

SCHEMBL31318501

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

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 4/20 0.41
SLC22A6 Q4U2R8 1/20 0.41
SLC22A8 Q8TCC7 1/20 0.41
MEN1 O00255 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
TAS1R3 Q7RTX0 1/20 0.32
TAS1R1 Q7RTX1 1/20 0.32
TAS1R2 Q8TE23 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL31318541 0.93 SLC22A12 (0.46) SLC22A12SLC22A6SLC22A8MEN1RAB9A
SCHEMBL31318535 0.93 SLC22A12 (0.38) SLC22A12SLC22A6SLC22A8MEN1RAB9A
SCHEMBL31318528 0.90 SLC22A6 (0.36) SLC22A12SLC22A6SLC22A8MEN1KMT2A
SCHEMBL31318505 0.88 SLC22A6 (0.50) SLC22A12SLC22A6SLC22A8MEN1KMT2A
SCHEMBL31318558 0.88 SLC22A6 (0.41) SLC22A12SLC22A6SLC22A8TDP1LMNA
SCHEMBL31318506 0.87 SLC22A12 (0.48) SLC22A12SLC22A6SLC22A8
SCHEMBL31318517 0.85 SIRT3 (0.41) SLC22A12MEN1KMT2AKDM4EALDH1A1
SCHEMBL31318529 0.83 SLC22A12 (0.57) SLC22A12SLC22A6SLC22A8
SCHEMBL31318515 0.83 SLC22A12 (0.44) SLC22A12SLC22A6SLC22A8
SCHEMBL31318491 0.80 TUBB4A (0.43) SLC22A12MEN1RAB9AKMT2AKDM4E

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