SCHEMBL22028066

SCHEMBL22028066

C=Cc1ccc(Cn2cc(C)c(=O)n(Cc3ccc(C=C)cc3)c2=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.48
▸ TP53 P04637 6/20 0.44
▸ LMNA P02545 2/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ CA1 P00915 1/20 0.40
▸ CA2 P00918 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ PSMD14 O00487 1/20 0.39
▸ TRPC5 Q9UL62 1/20 0.37
▸ POLB P06746 1/20 0.37

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
SCHEMBL22067605 0.84 TP53 (0.38) MAPTTP53LMNAL3MBTL1CA1
SCHEMBL22067844 0.81 L3MBTL1 (0.47) MAPTTP53L3MBTL1MEN1KMT2A
SCHEMBL7822161 0.80 L3MBTL1 (0.56) MAPTLMNAL3MBTL1MEN1KMT2A
SCHEMBL22028068 0.75 BRD4 (0.48) MAPTTP53L3MBTL1TRPC5
SCHEMBL6333309 0.74 HPGD (0.67) —
SCHEMBL20806246 0.73 CA12 (0.54) MAPTTP53LMNACA1CA2
SCHEMBL26127454 0.72 CA1 (0.42) MAPTTP53LMNACA1CA2
SCHEMBL27430453 0.70 CA1 (0.49) MAPTTP53LMNACA1CA2
SCHEMBL8124121 0.70 MAPT (0.46) MAPTTP53LMNACA1CA2
SCHEMBL19660075 0.70 KDM4E (0.44) MAPTTP53LMNAL3MBTL1

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
US-20200181317-A1 Bisphenol A-Free Crosslinked Polymer Composition WARNER BABCOCK INSTITUTE FOR GREEN CHEMISTRY, LLC (US) 2020-06-11 — — US disclosed
US-20200181317-A1 Bisphenol A-Free Crosslinked Polymer Composition WARNER BABCOCK INSTITUTE FOR GREEN CHEMISTRY, LLC (US) 2020-06-11 — — US disclosed
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