SCHEMBL9339137

SCHEMBL9339137

COC(=O)c1cc(/C=C/c2nc3cc(F)ccc3s2)ccc1OC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KAT8 Q9H7Z6 2/20 0.50
▸ MAPT P10636 6/20 0.47
▸ ALDH1A1 P00352 4/20 0.47
▸ MEN1 O00255 3/20 0.47
▸ KMT2A Q03164 3/20 0.47
▸ HTT P42858 3/20 0.47
▸ GAA P10253 3/20 0.47
▸ POLB P06746 2/20 0.47
▸ KDM4E B2RXH2 2/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ AHR P35869 1/20 0.46
▸ CLK1 P49759 1/20 0.44
▸ CLK2 P49760 1/20 0.44
▸ HCRTR1 O43613 1/20 0.43
▸ DYRK1A Q13627 1/20 0.43
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ PLA2G2A P14555 1/20 0.42
▸ LMNA P02545 2/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.41

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
SCHEMBL9389070 0.82 KAT8 (0.48) KAT8MAPTALDH1A1MEN1KMT2A
SCHEMBL9334957 0.82 KAT8 (0.48) KAT8MAPTALDH1A1MEN1KMT2A
SCHEMBL9337335 0.82 KAT8 (0.51) KAT8MAPTALDH1A1MEN1KMT2A
SCHEMBL9337315 0.82 KAT8 (0.51) KAT8MAPTALDH1A1MEN1KMT2A
SCHEMBL9339034 0.81 PLA2G2A (0.45) KAT8MAPTALDH1A1MEN1KMT2A
SCHEMBL9339042 0.81 PLA2G2A (0.45) KAT8MAPTALDH1A1MEN1KMT2A
SCHEMBL9339138 0.76 AHR (0.45) MAPTALDH1A1MEN1KMT2AHTT
SCHEMBL13926056 0.74 PTGS2 (0.59) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL4300383 0.73 SMN1; SMN2 (0.52) MAPTALDH1A1MEN1KMT2AHTT
SCHEMBL23111746 0.72 MEN1 (0.57) MAPTALDH1A1MEN1KMT2AHTT

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
US-5322847-A Inhibit platelet activating factor, block leukotriene D4 receptors PFIZER INC. (US) 1994-06-21 — — US disclosed
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