SCHEMBL31318544

SCHEMBL31318544

COc1c(F)cc(C(=O)N2CC3(CC3)Oc3ccccc32)cc1F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT3 Q9NTG7 1/20 0.41
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
TUBB4A P04350 2/20 0.37
TUBB P07437 2/20 0.37
TUBA3C P0DPH7 2/20 0.37
TUBA1B P68363 2/20 0.37
TUBA4A P68366 2/20 0.37
TUBB4B P68371 2/20 0.37
TUBB3 Q13509 2/20 0.37
TUBB2A Q13885 2/20 0.37
TUBB8 Q3ZCM7 2/20 0.37
TUBA3E Q6PEY2 2/20 0.37
TUBA1A Q71U36 2/20 0.37
TUBA1C Q9BQE3 2/20 0.37
TUBB6 Q9BUF5 2/20 0.37
TUBB2B Q9BVA1 2/20 0.37
TUBB1 Q9H4B7 2/20 0.37
KMT2A Q03164 2/20 0.36
TSHR P16473 1/20 0.36

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
SCHEMBL31318572 0.87 ATM (0.44) SIRT3LMNASMN1; SMN2KMT2AALDH1A1
SCHEMBL31318560 0.87 SIRT3 (0.41) SIRT3LMNASMN1; SMN2TUBB4ATUBB
SCHEMBL31318493 0.87 LMNA (0.42) SIRT3LMNASMN1; SMN2TUBB4ATUBB
SCHEMBL31318517 0.87 SIRT3 (0.41) SIRT3LMNATUBB4ATUBBTUBA3C
SCHEMBL31318516 0.86 SLC22A12 (0.43) SIRT3LMNAKMT2AALDH1A1SLC22A12
SCHEMBL31318552 0.86 TUBB4A (0.43) SIRT3LMNATUBB4ATUBBTUBA3C
SCHEMBL31318558 0.85 SLC22A6 (0.41) LMNATSHRSLC22A12
SCHEMBL31318570 0.83 PDE4B (0.39) LMNASMN1; SMN2TUBB4ATUBBTUBA3C
SCHEMBL31318571 0.82 NR3C2 (0.38) SIRT3LMNATSHRALDH1A1SLC22A12
SCHEMBL31318504 0.79 SLC22A12 (0.42) SIRT3LMNAKMT2AALDH1A1SLC22A12

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