SCHEMBL7273846

SCHEMBL7273846

N#Cc1cccc(C(=O)c2ccc(O)cc2)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLK1 P49759 2/20 0.58
DYRK1A Q13627 2/20 0.58
DYRK1B Q9Y463 2/20 0.58
P4HB P07237 2/20 0.56
GSK3B P49841 2/20 0.54
LMNA P02545 2/20 0.52
MAPT P10636 2/20 0.52
HTT P42858 2/20 0.52
ESR1 P03372 1/20 0.52
ESR2 Q92731 1/20 0.52
PKM P14618 1/20 0.52
HPGD P15428 1/20 0.52
STS P08842 1/20 0.51
VNN1 O95497 7/20 0.50
MEN1 O00255 2/20 0.50
RAB9A P51151 2/20 0.50
KMT2A Q03164 2/20 0.50
NPC1 O15118 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.47
ATM Q13315 1/20 0.47

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
SCHEMBL4201889 0.87 ATM (0.63) CLK1DYRK1ADYRK1BGSK3BVNN1
SCHEMBL9797519 0.85 GSK3B (0.53) CLK1DYRK1ADYRK1BGSK3BVNN1
SCHEMBL11445310 0.85 VNN1 (0.61) CLK1DYRK1ADYRK1BGSK3BVNN1
SCHEMBL6651723 0.85 GSK3B (0.53) CLK1DYRK1ADYRK1BGSK3BVNN1
SCHEMBL9856491 0.83 GSK3B (0.54) CLK1DYRK1ADYRK1BGSK3BVNN1
SCHEMBL5962921 0.81 CA2 (0.70) P4HBGSK3BLMNAMAPTHTT
SCHEMBL698836 0.81 LMNA (0.71) CLK1DYRK1ADYRK1BLMNAMAPT
SCHEMBL10395127 0.81 LMNA (0.71) CLK1DYRK1ADYRK1BLMNAMAPT
SCHEMBL7780410 0.81 VNN1 (0.63) P4HBGSK3BLMNAMAPTHPGD
SCHEMBL507406 0.81 GSK3B (0.60) GSK3BVNN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0483667-B1 Cyclic imino derivatives, process for their preparation and drugs containing them THOMAE GMBH DR K (DE) 1998-02-04 EP disclosed
US-5668282-A 4,5-cyclicimidazo[1,5-A]quinoxalines PHARMACIA & UPJOHN COMPANY (US) 1997-09-16 US disclosed
US-5591769-A PYRROLIDINE DERIVATIVES; ANTICOAGULANTS KARL THOMAE GMBH (DE) 1997-01-07 US disclosed
US-5541343-A ANTIAGGLOMERANTS FOR CELLS OR ANTICOAGULANTS KARL THOMAE GMBH (DE) 1996-07-30 US disclosed
EP-0288189-B1 IMPROVEMENTS IN OR RELATING TO LEUKOTRIENE ANTAGONISTS ELI LILLY AND COMPANY (US) 1992-11-11 EP disclosed
EP-0483667-A2 Cyclic imino derivatives, process for their preparation and drugs containing them Dr. Karl Thomae GmbH (DE) 1992-05-06 EP disclosed
US-4996347-A Anticoagulant FOURNIER INNOVATION ET SYNERGIE (FR) 1991-02-26 US disclosed
US-4877808-A ANTITHROMBOTICS FOURNIER INNOVATION ET SYNERGIE (FR) 1989-10-31 US disclosed
US-4853398-A ANTIALLERGENS ELI LILLY AND COMPANY (US) 1989-08-01 US disclosed
EP-0288189-A1 Improvements in or relating to leukotriene antagonists ELI LILLY AND COMPANY (US) 1988-10-26 EP disclosed