SCHEMBL3261016

SCHEMBL3261016

CCOc1n[nH]cc1-c1ccc(Cl)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ TDP1 Q9NUW8 3/20 0.39
▸ MAPT P10636 2/20 0.39
▸ ALPL P05186 1/20 0.38
▸ PRKAB2 O43741 2/20 0.37
▸ PRKAG1 P54619 2/20 0.37
▸ PRKAA2 P54646 2/20 0.37
▸ PRKAA1 Q13131 2/20 0.37
▸ PRKAG3 Q9UGI9 2/20 0.37
▸ PRKAG2 Q9UGJ0 2/20 0.37
▸ PRKAB1 Q9Y478 2/20 0.37
▸ GCGR P47871 1/20 0.37
▸ MAPK14 Q16539 1/20 0.37
▸ POLB P06746 2/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ RAB9A P51151 2/20 0.36

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
SCHEMBL3264005 0.83 SMN1; SMN2 (0.38) ALDH1A1HPGDMEN1KMT2ATDP1
SCHEMBL3263121 0.83 MAPK1 (0.43) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL2581949 0.78 CNR1 (0.54) HPGDMEN1KMT2A
SCHEMBL3264012 0.75 L3MBTL1 (0.51) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL24962591 0.73 IKBKB (0.41) MEN1KMT2ATDP1RAB9ANPC1
SCHEMBL24687080 0.72 — —
SCHEMBL29150813 0.71 KDM4E (0.44) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL15758806 0.71 ALPL (0.54) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL9735461 0.71 IKBKB (0.46) KDM4EALDH1A1HPGDALPLRAB9A
SCHEMBL3264021 0.70 HPGD (0.40) KDM4EALDH1A1HPGDMEN1KMT2A

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
WO-2010015656-A2 NEW ALKOXYPYRAZOLES INSTITUT PASTEUR (FR) 2010-02-11 — — WO disclosed
EP-2151434-A1 Alkoxypyrazoles and the process for their preparation Institut Pasteur (FR) 2010-02-10 — — EP disclosed
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