SCHEMBL20785348

SCHEMBL20785348

CCCc1ccnc(Oc2ccc(OC)cc2)c1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ LOXL2 Q9Y4K0 10/20 0.49
▸ LOX P28300 8/20 0.48
▸ NR3C2 P08235 1/20 0.43
▸ RAB9A P51151 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ SREBF2 Q12772 1/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ BLM P54132 1/20 0.40
▸ IGF1R P08069 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ NPC1 O15118 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ RXFP1 Q9HBX9 1/20 0.39

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
SCHEMBL24261152 0.87 LOXL2 (0.51) LOXL2LOXRAB9AALDH1A1L3MBTL1
SCHEMBL12093687 0.83 LOXL2 (0.65) LOXL2LOXNR3C2
SCHEMBL20784555 0.80 LOXL2 (0.48) LOXL2LOXRAB9AL3MBTL1NPC1
SCHEMBL17393176 0.74 CLK4 (0.54) NR3C2RAB9AIGF1RNPC1
SCHEMBL16453534 0.72 LOXL2 (0.71) LOXL2LOXRAB9AL3MBTL1NPC1
SCHEMBL19159805 0.72 PDE2A (0.48) LOXL2LOXRAB9ANPC1
SCHEMBL91277 0.71 TAAR1 (0.64) —
SCHEMBL19492384 0.71 LOX (0.57) LOXL2LOX
SCHEMBL3196793 0.71 TTR (0.54) ALDH1A1NPC1HTT
SCHEMBL28655990 0.71 LOXL2 (0.55) LOXL2LOX

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
WO-2019046784-A1 COMPOUNDS AND METHODS FOR MODULATING ADENOSINE A2B RECEPTOR AND ADENOSINE A2A RECEPTOR CORVUS PHARMACEUTICALS, INC. (US) 2019-03-07 — — WO disclosed
Send feedback