SCHEMBL9912636

SCHEMBL9912636

CCC(C)C(=O)Oc1ccc(N=Nc2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 8/20 0.47
▸ RAB9A P51151 7/20 0.47
▸ NPC1 O15118 5/20 0.47
▸ SMN1; SMN2 Q16637 5/20 0.47
▸ MEN1 O00255 4/20 0.47
▸ KMT2A Q03164 4/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ L3MBTL1 Q9Y468 2/20 0.47
▸ TDP1 Q9NUW8 2/20 0.47
▸ LMNA P02545 1/20 0.47
▸ ELANE P08246 2/20 0.45
▸ PPARA Q07869 5/20 0.45
▸ CASP3 P42574 1/20 0.44
▸ SENP8 Q96LD8 1/20 0.44
▸ SENP7 Q9BQF6 1/20 0.44
▸ SENP6 Q9GZR1 1/20 0.44
▸ HPGD P15428 1/20 0.43
▸ TRPA1 O75762 1/20 0.42
▸ PPARG P37231 4/20 0.42
▸ PPARD Q03181 3/20 0.42

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
SCHEMBL17131758 0.88 ELANE (0.45) MAPTRAB9ANPC1SMN1; SMN2MEN1
SCHEMBL17131747 0.88 MAPT (0.46) MAPTRAB9ANPC1KMT2AALDH1A1
SCHEMBL14996055 0.85 ELANE (0.50) MAPTRAB9ANPC1MEN1KMT2A
SCHEMBL650639 0.85 ELANE (0.50) MAPTRAB9ANPC1MEN1KMT2A
SCHEMBL17617137 0.85 ELANE (0.50) MAPTRAB9ANPC1MEN1KMT2A
SCHEMBL17131756 0.83 GSK3B (0.43) MAPTRAB9ANPC1SMN1; SMN2MEN1
SCHEMBL13750796 0.83 MGLL (0.45) MAPTRAB9AALDH1A1LMNAELANE
SCHEMBL14791147 0.83 PPARA (0.53) MAPTRAB9ANPC1SMN1; SMN2MEN1
SCHEMBL17122045 0.83 PPARA (0.53) MAPTRAB9ANPC1SMN1; SMN2MEN1
SCHEMBL12691162 0.83 MGLL (0.45) MAPTRAB9AALDH1A1LMNAELANE

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
EP-1560893-B1 PHOTOCHROMIC COMPOSITIONS AND LIGHT TRANSMISSIBLE ARTICLES ADVANCED POLYMERIK PTY LTD (AU) 2012-06-06 — — EP disclosed
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