SCHEMBL5339818

SCHEMBL5339818

Cn1ncc2cc(NC(=O)OCc3ccccc3)ccc21

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 1/20 0.57
▸ NPC1 O15118 2/20 0.56
▸ ALDH1A1 P00352 2/20 0.56
▸ MAPT P10636 2/20 0.56
▸ RAB9A P51151 2/20 0.56
▸ HPGD P15428 1/20 0.56
▸ ALOX12 P18054 1/20 0.56
▸ PDE1C Q14123 2/20 0.55
▸ MGLL Q99685 2/20 0.52
▸ ROCK2 O75116 2/20 0.52
▸ POLB P06746 1/20 0.51
▸ EGFR P00533 1/20 0.51
▸ ERBB2 P04626 1/20 0.51
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ TP53 P04637 1/20 0.50
▸ TSHR P16473 1/20 0.50
▸ ATM Q13315 1/20 0.50
▸ MAOB P27338 2/20 0.47
▸ MAOA P21397 1/20 0.47
▸ ACHE P22303 1/20 0.47

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
SCHEMBL5336933 0.85 ROCK2 (0.49) NPC1ALDH1A1MAPTRAB9AMGLL
SCHEMBL6097584 0.82 ROCK2 (0.48) NPC1ALDH1A1MAPTRAB9AMGLL
SCHEMBL16696385 0.80 RAB9A (0.53) NOTUMNPC1ALDH1A1MAPTRAB9A
SCHEMBL16686040 0.78 NPC1 (0.63) NOTUMNPC1ALDH1A1MAPTRAB9A
SCHEMBL29510910 0.78 NPC1 (0.78) NOTUMNPC1ALDH1A1MAPTRAB9A
SCHEMBL7836906 0.77 ADORA2B (0.57) NPC1ALDH1A1MAPTRAB9AMGLL
SCHEMBL4432278 0.77 MGLL (0.65) NPC1ALDH1A1MAPTRAB9AMGLL
SCHEMBL30207797 0.77 MGLL (0.65) NPC1ALDH1A1MAPTRAB9AMGLL
SCHEMBL16406932 0.77 NOTUM (0.54) NOTUMNPC1ALDH1A1MAPTRAB9A
SCHEMBL4202829 0.76 TP53 (0.52) NPC1ALDH1A1MAPTRAB9AMGLL

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
WO-2007088478-A1 INDAZOLE OXAZOLIDINONES AS ANTIBACTERIAL AGENTS PFIZER PRODUCTS INC. (US) 2007-08-09 — — WO disclosed
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