SCHEMBL16433534

SCHEMBL16433534

Cc1ccc(C)c(CN=[N+]=[N-])c1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TAAR1 Q96RJ0 1/20 0.47
▸ POLB P06746 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ HTT P42858 2/20 0.34
▸ KAT2B Q92831 1/20 0.34
▸ MCL1 Q07820 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ RAPGEF4 Q8WZA2 1/20 0.33
▸ PDE2A O00408 1/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ MAPT P10636 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ TACR1 P25103 1/20 0.33

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
SCHEMBL19446033 0.86 KAT2B (0.33) TAAR1ALDH1A1TDP1KAT2BMCL1
SCHEMBL16215286 0.85 TAAR1 (0.34) TAAR1KAT2BMCL1PDE2AKMT2A
SCHEMBL15290182 0.84 PYCR1 (0.39) TAAR1ALDH1A1TDP1HTTKAT2B
SCHEMBL17146957 0.83 SLC6A4 (0.39) TAAR1KAT2BMCL1GAAPDE2A
SCHEMBL19248859 0.83 CYP3A4 (0.38) TAAR1POLBALDH1A1HTTKAT2B
SCHEMBL14635996 0.81 FFAR4 (0.33) TAAR1KAT2BMCL1NPC1RAB9A
SCHEMBL16433537 0.79 MCL1 (0.36) ALDH1A1KAT2BMCL1PDE2AMAPT
SCHEMBL15432698 0.79 PDE2A (0.53) POLBPDE2AMAPT
SCHEMBL19649802 0.79 ALDH1A1 (0.38) ALDH1A1KAT2BGAAKDM4E
SCHEMBL15195911 0.78 MCL1 (0.33) KAT2BMCL1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1025057-B1 THERMAL INSULATING COATING BASF SE (DE) 2017-08-23 — — EP disclosed
EP-2832821-A1 CHOLESTERIC LIQUID CRYSTAL MIXTURE, FILM, INFRARED REFLECTING PLATE, LAMINATED ARTICLE, AND LAMINATED GLASS Fujifilm Corporation (JP) 2015-02-04 — — EP disclosed
EP-2833172-A1 LIGHT-REFLECTING LAYER, LIGHT-REFLECTING PLATE, INTERLAYER SHEET FOR LAMINATED GLASS, LAMINATED GLASS AND PROCESSES FOR PRODUCITON OF SAME FUJIFILM Corporation (JP) 2015-02-04 — — EP disclosed
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