SCHEMBL19460929

SCHEMBL19460929

[c]1ccc2sc(-c3ccc4ncsc4c3)nc2c1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 1/20 0.47
▸ APP P05067 7/20 0.41
▸ RIPK1 Q13546 1/20 0.40
▸ KDM4E B2RXH2 2/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ HKDC1 Q2TB90 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ TGFBR1 P36897 6/20 0.39
▸ BMPR1A P36894 1/20 0.39
▸ SMAD2 Q15796 1/20 0.39
▸ PFKFB3 Q16875 1/20 0.37
▸ GLA P06280 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ MAPT P10636 1/20 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
SCHEMBL3681813 0.78 RIPK2 (0.38) DYRK1AAPPKDM4ENPC1RAB9A
SCHEMBL547703 0.75 DYRK1A (0.49) DYRK1AAPPRIPK1TGFBR1BMPR1A
SCHEMBL3964625 0.73 KDM4E (0.49) APPKDM4ENPC1RAB9AL3MBTL1
SCHEMBL27972125 0.73 DYRK1A (0.53) DYRK1AAPPRIPK1KDM4ENPC1
SCHEMBL547334 0.72 KDM4E (0.38) KDM4ENPC1RAB9ATDP1L3MBTL1
SCHEMBL30302 0.72 — —
SCHEMBL454744 0.72 — —
SCHEMBL31214345 0.72 DYRK1A (0.72) DYRK1AAPPRIPK1KDM4ENPC1
SCHEMBL5544172 0.71 ATP4A (0.60) KDM4ENPC1RAB9AL3MBTL1MAPT
SCHEMBL447980 0.71 APP (0.55) DYRK1AAPPRIPK1KDM4ENPC1

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-3229977-A1 COMPOSITIONS AND METHODS FOR BONDING GLUES, ADHESIVES, AND COATINGS TO SURFACES University of Virginia Patent Foundation, D/B/A University of Virginia (US) 2017-10-18 — — EP disclosed
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