SCHEMBL30949533

SCHEMBL30949533

Cc1ccc(I)c(N=[N+]=[N-])c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCC9 O60706 1/20 0.39
KCNJ11 Q14654 1/20 0.39
SLC6A3 Q01959 3/20 0.35
TUBB4A P04350 1/20 0.32
TUBB P07437 1/20 0.32
TUBA3C P0DPH7 1/20 0.32
TUBA1B P68363 1/20 0.32
TUBA4A P68366 1/20 0.32
TUBB4B P68371 1/20 0.32
TUBB3 Q13509 1/20 0.32
TUBB2A Q13885 1/20 0.32
TUBB8 Q3ZCM7 1/20 0.32
TUBA3E Q6PEY2 1/20 0.32
TUBA1A Q71U36 1/20 0.32
TUBA1C Q9BQE3 1/20 0.32
TUBB6 Q9BUF5 1/20 0.32
TUBB2B Q9BVA1 1/20 0.32
TUBB1 Q9H4B7 1/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 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
SCHEMBL27098091 0.81 NPC1 (0.38) SLC6A3TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL14306432 0.79 TUBB4A (0.46) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL16118297 0.76 MAPT (0.53) NPC1RAB9AMAPTMAPK1L3MBTL1
SCHEMBL14394775 0.76 NPC1 (0.35) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL28460527 0.76 NPC1 (0.52) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL27663500 0.76 ABCC9 (0.39) ABCC9KCNJ11SLC6A3
SCHEMBL29506804 0.75 NPC1 (0.46) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL26870421 0.75 NPC1 (0.46) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL19478529 0.73 ACHE (0.50) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL15856945 0.72 TRPA1 (0.46) NPC1RAB9AMAPTPKMMAPK1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4652154-A1 NOVEL ALPK1 INHIBITORS Pyrotech (Beijing) Biotechnology Co., Ltd. (CN) 2025-11-26 EP disclosed
WO-2024153225-A1 NOVEL ALPK1 INHIBITORS PYROTECH (BEIJING) BIOTECHNOLOGY CO., LTD. (CN) 2024-07-25 WO disclosed