SCHEMBL936111

SCHEMBL936111

c1ccc(N2CCN=N2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
KDM4E B2RXH2 2/20 0.44
MAPK1 P28482 2/20 0.44
GLA P06280 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
SIGMAR1 Q99720 4/20 0.42
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MAOB P27338 2/20 0.38
LMNA P02545 2/20 0.38
HTR3E A5X5Y0 1/20 0.37
HTR3B O95264 1/20 0.37
ADRB1 P08588 1/20 0.37
HTR3A P46098 1/20 0.37
HTR3D Q70Z44 1/20 0.37
HTR3C Q8WXA8 1/20 0.37
HPGD P15428 1/20 0.34

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
SCHEMBL28355626 0.90 KDM4E (0.33) MAPTNPC1RAB9AKDM4EMAPK1
SCHEMBL3837134 0.80 MAOB (0.42) MAPTKDM4ETDP1L3MBTL1MEN1
SCHEMBL10930459 0.70 KEAP1 (0.47) MAPTNPC1RAB9AKDM4EMAPK1
SCHEMBL15416016 0.70 PLD1 (0.47) MAPTKDM4EMAPK1MEN1KMT2A
SCHEMBL3837138 0.70 ADRB1 (0.44) MAPTTDP1MEN1KMT2ALMNA
SCHEMBL4721848 0.70 MAPT (0.42) MAPTNPC1RAB9AKDM4EMAPK1
SCHEMBL482166 0.67 MAPT (0.44) MAPTNPC1RAB9AKDM4EMAPK1
SCHEMBL44773 0.65 TP53 (0.48) MAPTNPC1RAB9AKDM4EMAPK1
SCHEMBL6304342 0.65 TP53 (0.48) MAPTNPC1RAB9AKDM4EMAPK1
SCHEMBL11424097 0.64 KDM4E (0.37) MAPTNPC1RAB9AKDM4EMAPK1

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 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3728339-B1 COMPOSITION FOR OPHTHALMOLOGICAL PRODUCTS AMO Ireland (IE) 2022-07-06 EP disclosed
EP-3728339-A1 COMPOSITION FOR OPHTHALMOLOGICAL PRODUCTS Merck Patent GmbH (DE) 2020-10-28 EP disclosed
EP-3502147-A1 COMPOSITION FOR OPHTHALMOLOGICAL PRODUCTS Merck Patent GmbH (DE) 2019-06-26 EP disclosed
EP-2405757-B1 FUNCTIONALIZED 4- AND 5-VINYL SUBSTITUTED REGIOISOMERS OF 1,2,3-TRIAZOLES VIA 1,3-DIPOLAR CYCLOADDITION AND POLYMERS THEREOF ISP INVESTMENTS INC (US) 2017-11-08 EP disclosed
EP-2453749-A1 USE OF PHENYL TRIAZOLES FOR CONTROLLING INSECTS AND SPIDER MITES BY SPLASHING, MISTING OR IMMERSION OR BY TREATMENT OF SEEDS Bayer Cropscience AG (DE) 2012-05-23 EP disclosed
EP-2453750-A2 SYNERGISTIC ACTIVE SUBSTANCE COMBINATIONS CONTAINING PHENYL TRIAZOLES Bayer CropScience AG (DE) 2012-05-23 EP disclosed
CN-1989140-B Compounds containing a n-heteroaryl moiety linked to fused ring moieties for the inhibition of nad(p)h oxidases and platelet activation VASOPHARM BIOTECH GMBH 2012-01-11 CN disclosed
US-7897733-B2 Rapamycin conjugates and antibodies PFIZER, INC. (US) 2011-03-01 US disclosed
WO-2011006603-A2 SYNERGISTIC ACTIVE SUBSTANCE COMBINATIONS CONTAINING PHENYL TRIAZOLES BAYER CROPSCIENCE AG (DE) 2011-01-20 WO disclosed
WO-2011006605-A1 USE OF PHENYL TRIAZOLES FOR CONTROLLING INSECTS AND SPIDER MITES BY SPLASHING, MISTING OR IMMERSION OR BY TREATMENT OF SEEDS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2011-01-20 WO disclosed
WO-1998057969-A1 4-HALOALKYL-3- HETEROCYCLYLPYRIDINES AND 4-HALOALKYL -5-HETEROCYCLYLPYRIDINES, METHOD FOR THE PRODUCTION THEREOF, AGENTS CONTAINING THE SAME AND THEIR USE AS PESTICIDES HOECHST SCHERING AGREVO GMBH (DE) 1998-12-23 WO disclosed
EP-0710110-A4 RAPAMYCIN CONJUGATES AND ANTIBODIES ABBOTT LAB (US) 1997-06-18 EP disclosed
EP-0710110-A1 RAPAMYCIN CONJUGATES AND ANTIBODIES ABBOTT LABORATORIES (US) 1996-05-08 EP disclosed
WO-1994025072-A1 RAPAMYCIN CONJUGATES AND ANTIBODIES AMERICAN HOME PRODUCTS CORPORATION (US) 1994-11-10 WO disclosed
WO-1994025022-A1 RAPAMYCIN CONJUGATES AND ANTIBODIES ABBOTT LABORATORIES (US) 1994-11-10 WO disclosed
EP-0597360-A1 Substituted N-phenyl-triazolin (thi)ones, processes and intermediates for their production and their use as herbicides, insecticides and acaricides BAYER AG (DE) 1994-05-18 EP disclosed
US-4782081-A Compounds and methods useful for the synthesis of thromboxane A2 THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 1988-11-01 US disclosed
US-4672131-A Compounds and methods useful for the synthesis of thromboxane A2 THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 1987-06-09 US disclosed
EP-0223844-A1 COMPOUNDS AND METHODS USEFUL FOR THE SYNTHESIS OF THROMBOXANE A 2? THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 1987-06-03 EP disclosed
WO-1986007058-A1 COMPOUNDS AND METHODS USEFUL FOR THE SYNTHESIS OF THROMBOXANE A2 THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF (US) 1986-12-04 WO disclosed