SCHEMBL9199484

SCHEMBL9199484

COc1cc(C(=O)N(C(C)C)C2CCCCC2)ccc1CBr

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.44
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
TP53 P04637 1/20 0.42
HTT P42858 1/20 0.42
SLC6A9 P48067 1/20 0.41
REN P00797 3/20 0.41
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
GAA P10253 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
MAPK1 P28482 1/20 0.39
MAPT P10636 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
SCHEMBL9377208 0.87 MEN1 (0.46) TSHRMEN1KMT2ANPSR1TP53
SCHEMBL9543443 0.86 TSHR (0.43) TSHRMEN1KMT2ANPSR1TP53
SCHEMBL9205403 0.85 MEN1 (0.44) TSHRMEN1KMT2ANPSR1TP53
SCHEMBL9541768 0.85 ALDH1A1 (0.42) TSHRMEN1KMT2ANPSR1TP53
SCHEMBL9541755 0.82 CYP1A2 (0.45) TSHRMEN1KMT2ANPSR1REN
SCHEMBL9542202 0.82 MEN1 (0.47) TSHRMEN1KMT2ANPSR1TP53
SCHEMBL9542239 0.82 TSHR (0.42) TSHRNPSR1TP53HTTSLC6A9
SCHEMBL9541760 0.79 TUBB4A (0.51) MEN1KMT2ASLC6A9MAPT
SCHEMBL9540839 0.79 TP53 (0.41) TSHRMEN1KMT2ANPSR1TP53
SCHEMBL9208637 0.79 SLC6A9 (0.44) MEN1KMT2ANPSR1HTTSLC6A9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0344414-B1 5-Substitued imidazo[4,5-c]pyridines SEARLE & CO (US) 1994-10-12 EP claimed
EP-0680478-A1 N,N'-CYCLOALKYL/ALKYL CARBOXAMIDE 4H-IMIDAZO 4,5-b]PYRIDINE COMPOUNDS AS PAF ANTAGONISTS G.D. SEARLE & CO. (US) 1995-11-08 EP disclosed
EP-0670838-A1 SUBSTITUTED-PHENYL(N,N'-CYCLOALKYL/ALKYL CARBOXAMIDE)-1H/3H-IMIDAZO 4,5-b]PYRIDINE COMPOUNDS AS PAF ANTAGONISTS G.D. SEARLE & CO. (US) 1995-09-13 EP disclosed
EP-0404797-B1 1H/3H-[4-(N,N-CYCLOALKYL AND/OR BRANCHED-ALKYLCARBOXAMIDO) -BENZYL]IMIDAZO[4,5-c]PYRIDINES AS PAF ANTAGONISTS SEARLE & CO (US) 1995-02-01 EP disclosed
WO-1994029307-A1 PYRROLO[3,2-B]PYRIDINYLALKYL BENZAMIDE DERIVATIVES G.D. SEARLE & CO. (US) 1994-12-22 WO disclosed
US-5360907-A Platelet activating factor G.D. SEARLE & CO. (US) 1994-11-01 US disclosed
US-5359073-A Substituted-phenyl (N,N'-cycloalkyl/alkyl carboxamide)-1H/3H-imidazo[4,5-b]pyridine compounds as PAF antagonists G. D. SEARLE & CO. (US) 1994-10-25 US disclosed
EP-0344414-B1 5-Substitued imidazo[4,5-c]pyridines SEARLE & CO (US) 1994-10-12 EP disclosed
WO-1994017063-A1 N,N'-CYCLOALKYL/ALKYL CARBOXAMIDE 4H-IMIDAZO[4,5-b]PYRIDINE COMPOUNDS AS PAF ANTAGONISTS G.D. SEARLE & CO. (US) 1994-08-04 WO disclosed
WO-1994012500-A1 SUBSTITUTED-PHENYL(N,N'-CYCLOALKYL/ALKYL CARBOXAMIDE)-1H/3H-IMIDAZO[4,5-b]PYRIDINE COMPOUNDS AS PAF ANTAGONISTS G.D. SEARLE & CO. (US) 1994-06-09 WO disclosed
US-5302601-A Useful in the treatment of diseases mediated by platelet activating factor G. D. SEARLE & CO. (US) 1994-04-12 US disclosed
US-5262426-A Treatment of cardiovascular disorders, antiinflammatory agents G. D. SEARLE & CO. (US) 1993-11-16 US disclosed
US-5223539-A Antagonist of platelet activating factor G. D. SEARLE & CO. (US) 1993-06-29 US disclosed
WO-1993010077-A1 N,N-DI-ALKYL(PHENOXY)BENZAMIDE DERIVATIVES G.D. SEARLE & CO. (US) 1993-05-27 WO disclosed
US-5208242-A 5-substituted-4-phenyl-5H-imidazo[4,5-c]pyridine derivatives G. D. SEARLE & CO. (US) 1993-05-04 US disclosed
EP-0404797-A4 1H/3H- 4-(N,N-DICYCLOALKYL/BRANCHED-ALKYLCARBOXAMIDO)-BENZYL)IMIDAZO 4,5-C)PYRIDINES AS PAF ANTAGONISTS 1992-01-22 EP disclosed
EP-0404797-A1 1H/3H- 4-(N,N-DICYCLOALKYL/BRANCHED-ALKYLCARBOXAMIDO)-BENZYL]IMIDAZO 4,5-c]PYRIDINES AS PAF ANTAGONISTS. SEARLE & CO (US) 1991-01-02 EP disclosed
WO-1989008653-A1 1H/3H-[4-(N,N-DICYCLOALKYL/BRANCHED-ALKYLCARBOXAMIDO)-BENZYL]IMIDAZO[4,5-c]PYRIDINES AS PAF ANTAGONISTS G.D. SEARLE & CO. (US) 1989-09-21 WO disclosed