SCHEMBL31318514

SCHEMBL31318514

COc1c(F)cc(C(=O)N2CC3(CC3)Sc3ccccc32)cc1F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
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
TSHR P16473 1/20 0.36
BCHE P06276 3/20 0.35
ACHE P22303 3/20 0.35

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
SCHEMBL31318568 0.87 LMNA (0.42) LMNASMN1; SMN2TUBB4ATUBBTUBA3C
SCHEMBL31318510 0.87 SLC22A12 (0.41) LMNATUBB4ATUBBTUBA3CTUBA1B
SCHEMBL10323593 0.80 SLC22A12 (0.50) LMNASMN1; SMN2TUBB4ATUBBTUBA3C
SCHEMBL31318574 0.78 NOTUM (0.54) LMNASMN1; SMN2TSHRHPGDTHRB
SCHEMBL31318562 0.77 SLC22A12 (0.39) BCHEHPGDALDH1A1THRBMEN1
SCHEMBL31318576 0.77 SLC22A12 (0.50) BCHEACHEALDH1A1SLC22A12
SCHEMBL31318544 0.76 SIRT3 (0.41) LMNASMN1; SMN2TUBB4ATUBBTUBA3C
SCHEMBL31318531 0.74 LMNA (0.38) LMNASMN1; SMN2TUBB4ATUBBTUBA3C
SCHEMBL10322242 0.73 SLC22A12 (0.46) LMNASMN1; SMN2TUBB4ATUBBTUBA3C
SCHEMBL31318570 0.72 PDE4B (0.39) LMNASMN1; SMN2TUBB4ATUBBTUBA3C

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