SCHEMBL28053434

SCHEMBL28053434

N#Cc1cccc(Br)c1OCCO

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ DYRK1A Q13627 1/20 0.36
▸ MCHR1 Q99705 1/20 0.35
▸ ESR2 Q92731 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ PRKAB2 O43741 1/20 0.32
▸ PRKAG1 P54619 1/20 0.32
▸ PRKAA2 P54646 1/20 0.32
▸ PRKAA1 Q13131 1/20 0.32
▸ PRKAG3 Q9UGI9 1/20 0.32
▸ PRKAG2 Q9UGJ0 1/20 0.32
▸ PRKAB1 Q9Y478 1/20 0.32
▸ NAMPT P43490 1/20 0.32
▸ PDE4B Q07343 1/20 0.31

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
SCHEMBL24553670 0.92 DYRK1A (0.35) ARMEN1KMT2AALDH1A1DYRK1A
SCHEMBL1761182 0.82 TSHR (0.39) ARMEN1KMT2AALDH1A1DYRK1A
SCHEMBL25816117 0.82 PTGES (0.35) MEN1KMT2AALDH1A1DYRK1ANPC1
SCHEMBL9957027 0.82 ALDH1A1 (0.46) MEN1KMT2AALDH1A1RECQLMCHR1
SCHEMBL20621276 0.80 TSHR (0.46) ARALDH1A1RECQLESR2
SCHEMBL29122661 0.79 DYRK1A (0.38) ARMEN1KMT2AALDH1A1DYRK1A
SCHEMBL21143326 0.77 EGFR (0.39) ALDH1A1DYRK1ANPC1RAB9ANAMPT
SCHEMBL30509819 0.77 EGFR (0.39) ALDH1A1DYRK1ANPC1RAB9ANAMPT
SCHEMBL22096797 0.76 LMNA (0.39) ARKMT2AALDH1A1RECQLESR2
SCHEMBL19768964 0.76 GABRA1 (0.40) ARALDH1A1RECQLNAMPT

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
CN-105377847-A Kinase inhibitors CHIESI FARM SPA 2016-03-02 — — CN disclosed
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