SCHEMBL6997464

SCHEMBL6997464

NC(=O)c1ccccc1-c1ccc2[nH]ccc2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PI4K2A Q9BTU6 1/20 0.55
AR P10275 1/20 0.54
NPC1 O15118 1/20 0.53
BCAT2 O15382 1/20 0.51
IKBKB O14920 3/20 0.51
CHUK O15111 2/20 0.50
CHEK1 O14757 1/20 0.49
GUSB P08236 2/20 0.47
PDPK1 O15530 1/20 0.46
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
CSNK1A1 P48729 1/20 0.46
TYRO3 Q06418 1/20 0.46
DYRK1B Q9Y463 1/20 0.46
PTGS2 P35354 1/20 0.45
LCK P06239 1/20 0.44
BTK Q06187 1/20 0.44
ENPP2 Q13822 1/20 0.44

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
SCHEMBL28264516 1.00 PI4K2A (0.55) PI4K2AARNPC1BCAT2IKBKB
SCHEMBL27682000 0.88 LCK (0.56) PI4K2AARBCAT2IKBKBCHUK
SCHEMBL28136345 0.88 LCK (0.56) PI4K2AARBCAT2IKBKBCHUK
SCHEMBL30369932 0.88 LCK (0.56) PI4K2AARBCAT2IKBKBCHUK
SCHEMBL29479418 0.87 NPC1 (0.58) PI4K2AARNPC1GUSBPTGS2
SCHEMBL7085439 0.85 NPC1 (0.53) PI4K2AARNPC1CHEK1GUSB
SCHEMBL29940583 0.81 CCNC (0.60) PI4K2AARIKBKBCHUK
SCHEMBL8523957 0.78 PI4K2A (0.51) PI4K2AARNPC1IKBKBCHUK
SCHEMBL31621280 0.78 SLC6A2 (0.64) NPC1BCAT2IKBKBCHEK1CSNK1A1
SCHEMBL31621279 0.78 SLC6A2 (0.64) NPC1BCAT2IKBKBCHEK1CSNK1A1

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-1340750-A1 AMIDE DERIVATIVES YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 2003-09-03 EP claimed
EP-4139291-A1 COLLAGEN 1 TRANSLATION INHIBITORS AND METHODS OF USE THEREOF Anima Biotech Inc. (US) 2023-03-01 EP disclosed
WO-2021216665-A1 COLLAGEN 1 TRANSLATION INHIBITORS AND METHODS OF USE THEREOF ANIMA BIOTECH INC. (US) 2021-10-28 WO disclosed