SCHEMBL6206101

SCHEMBL6206101

Clc1ncnc(Nc2ccccc2Cl)n1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.68
SMN1; SMN2 Q16637 2/20 0.63
NPC1 O15118 1/20 0.63
RAB9A P51151 1/20 0.63
IGF1R P08069 3/20 0.54
LMNA P02545 1/20 0.54
AURKA O14965 4/20 0.46
HDAC3 O15379 1/20 0.45
HDAC1 Q13547 1/20 0.45
HDAC2 Q92769 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
TTBK1 Q5TCY1 1/20 0.45
TTBK2 Q6IQ55 1/20 0.45
HTT P42858 1/20 0.45
PTK2 Q05397 1/20 0.45
FLT3 P36888 1/20 0.43
IRAK4 Q9NWZ3 1/20 0.43
AURKB Q96GD4 1/20 0.43
ULK1 O75385 1/20 0.43
CCNB2 O95067 1/20 0.43

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
SCHEMBL13395050 0.83 AURKA (0.47) TSHRSMN1; SMN2NPC1RAB9ALMNA
SCHEMBL17366289 0.83 HTT (0.67) TSHRSMN1; SMN2NPC1RAB9ALMNA
SCHEMBL6482620 0.81 ULK1 (0.49) TSHRSMN1; SMN2NPC1RAB9ALMNA
Dyrene SCHEMBL6750152 0.81 TSHR (1.00) TSHRSMN1; SMN2NPC1RAB9AIGF1R
Dyrene SCHEMBL1903290 0.81 TSHR (1.00) TSHRSMN1; SMN2NPC1RAB9AIGF1R
Dyrene SCHEMBL133054 0.81 TSHR (1.00) TSHRSMN1; SMN2NPC1RAB9AIGF1R
Dyrene SCHEMBL29364667 0.81 TSHR (1.00) TSHRSMN1; SMN2NPC1RAB9AIGF1R
Dyrene SCHEMBL8166670 0.81 TSHR (1.00) TSHRSMN1; SMN2NPC1RAB9AIGF1R
Dyrene SCHEMBL13280 0.81 TSHR (1.00) TSHRSMN1; SMN2NPC1RAB9AIGF1R
Dyrene SCHEMBL8881784 0.79 TSHR (0.96) TSHRSMN1; SMN2NPC1RAB9AIGF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1524416-A N-(4,6-dimethyl pyridine-2-yl) aniline sterilization combination 马韵升 2004-09-01 CN claimed
CN-1385069-A N- (4, 6-dimethyl pyrimidine-2-yl) aniline sterilization composition MA YUNSHENG (CN) 2002-12-18 CN claimed
CN-1359620-A Fungicidal composition XU BOYONG (CN) 2002-07-24 CN claimed
CN-1314083-A Sterilizing agent composition SHENYANG CHEMIAL RES INST (CN) 2001-09-26 CN claimed
CN-102318622-A Fungicidal mixture based on azoles and pyrimidine radicals amine BASF AG 2012-01-18 CN disclosed
CN-102256492-A Synergistic fungicidal mixtures BASF SE 2011-11-23 CN disclosed
CN-102105060-A Synergistic fungicidal mixtures BASF SE 2011-06-22 CN disclosed
CN-102088857-A Pesticidal mixtures comprising isoxazoline compounds ii BASF SE 2011-06-08 CN disclosed
CN-101909448-A Pesticidal mixtures comprising cyanosulfoximine compounds BASF SE 2010-12-08 CN disclosed
CN-101087530-B Fungicidal mixtures BASF AG 2010-10-13 CN disclosed
CN-101822260-A Fungicidal mixture BASF SE 2010-09-08 CN disclosed
CN-101808521-A ternary fungicidal compositions comprising boscalid and chlorothalonil BASF SE 2010-08-18 CN disclosed
WO-2003076392-A2 Z-SUBSTITUTED ACRYLAMIDES, METHODS FOR PRODUCTION THEREOF AND AGENTS COMPRISING THE SAME BASF AKTIENGESELLSCHAFT (DE) 2003-09-18 WO disclosed
WO-2003043993-A1 5-PHENYLPYRIMIDINES, AGENTS COMPRISING THE SAME, METHOD FOR PRODUCTION AND USE THEREOF BASF AKTIENGESELLSCHAFT (DE) 2003-05-30 WO disclosed
WO-2003004465-A2 FUNGICIDAL TRIAZOLOPYRIMIDINES, METHOD FOR THE PRODUCTION THEREOF AND USE THEREOF IN CONTROLLING NOXIOUS FUNGI AND AGENTS CONTAINING SAID COMPOUNDS BASF AKTIENGESELLSCHAFT (DE) 2003-01-16 WO disclosed
CN-1385069-A N- (4, 6-dimethyl pyrimidine-2-yl) aniline sterilization composition MA YUNSHENG (CN) 2002-12-18 CN disclosed
CN-1359620-A Fungicidal composition XU BOYONG (CN) 2002-07-24 CN disclosed
WO-2002038565-A2 7-(R)-AMINO-TRIAZOLOPYRIMIDINES, THE PRODUCTION THEREOF AND USE OF THE SAME FOR COMBATING PHYTOPATHOGENIC FUNGI BASF AKTIENGESELLSCHAFT (DE) 2002-05-16 WO disclosed
CN-1069636-C Carbamoyl carboxylic acid amides BASF AG (DE) 2001-08-15 CN disclosed
CN-1159182-A Carbamyl carboxamides BASF AG (DE) 1997-09-10 CN disclosed