SCHEMBL16112102

SCHEMBL16112102

FC(F)(F)Oc1ccc(-n2cncn2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.55
CYP2D6 P10635 1/20 0.55
CYP2C9 P11712 1/20 0.55
CYP2C19 P33261 1/20 0.55
SMN1; SMN2 Q16637 3/20 0.51
ALDH1A1 P00352 2/20 0.51
KDM4E B2RXH2 1/20 0.51
LMNA P02545 1/20 0.48
CYP2A6 P11509 1/20 0.43
SCN5A Q14524 3/20 0.42
FBP1 P09467 1/20 0.42
POLB P06746 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
RXRA P19793 2/20 0.42
GRIN1 Q05586 2/20 0.42
GRIN2B Q13224 2/20 0.42
GRM7 Q14831 2/20 0.40
GLA P06280 1/20 0.40
HPGD P15428 1/20 0.40
HSP90AA1 P07900 1/20 0.40

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
SCHEMBL16111764 0.86 CYP1A2 (0.53) CYP1A2CYP2D6CYP2C9CYP2C19SMN1; SMN2
SCHEMBL4950544 0.79 CYP1A2 (0.49) CYP1A2CYP2D6CYP2C9CYP2C19SMN1; SMN2
SCHEMBL20090030 0.78 ALDH1A1 (0.55) CYP1A2CYP2D6CYP2C9CYP2C19SMN1; SMN2
SCHEMBL2095205 0.78 CYP1A2 (0.58) CYP1A2CYP2D6CYP2C9CYP2C19SMN1; SMN2
SCHEMBL2095209 0.78 CYP1A2 (0.63) CYP1A2CYP2D6CYP2C9CYP2C19SMN1; SMN2
SCHEMBL7016284 0.75 CYP1A2 (0.55) CYP1A2CYP2D6CYP2C9CYP2C19SMN1; SMN2
SCHEMBL2568215 0.75 LMNA (0.46) CYP1A2CYP2C9CYP2C19LMNAPOLB
SCHEMBL12012871 0.74 KDM4E (0.41) CYP1A2CYP2D6CYP2C9CYP2C19SMN1; SMN2
SCHEMBL2097220 0.74 CYP1A2 (0.67) CYP1A2CYP2D6CYP2C9CYP2C19SMN1; SMN2
SCHEMBL16556797 0.74 NOTUM (0.53) ALDH1A1KDM4ESCN5APOLBL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109906033-A Molecules having certain pesticidal utility, and intermediates, compositions, and methods related thereto 美国陶氏益农公司 2019-06-18 CN disclosed
CN-109476629-A The bicyclic derivatives that urea and thiocarbamide replace are as pesticides 先正达参股股份有限公司 2019-03-15 CN disclosed
CN-106573900-B Molecule and relative intermediate, composition and method with certain desinsection effectiveness 美国陶氏益农公司 2018-09-14 CN disclosed
CN-108290832-A Molecules having pesticidal utility, and intermediates, compositions and methods related thereto 美国陶氏益农公司 2018-07-17 CN disclosed
CN-108137489-A Molecule and relative intermediate, composition and method with desinsection effectiveness 美国陶氏益农公司 2018-06-08 CN disclosed
CN-107573295-A Molecule and intermediate, composition and its correlation technique with certain agricultural chemicals effectiveness 美国陶氏益农公司 2018-01-12 CN disclosed
CN-107428699-A Pesticidally active carbamylated and thiocarbamoylated oxime derivatives 先正达参股股份有限公司 2017-12-01 CN disclosed
CN-105209450-B Molecules and intermediates having pesticidal utility, compositions and methods relating thereto 美国陶氏益农公司 2017-10-20 CN disclosed
CN-107105657-A Molecule and relative intermediate, composition and method with desinsection effectiveness 美国陶氏益农公司 2017-08-29 CN disclosed
CN-106572658-A Molecules having certain pesticidal utilities, and intermediates, compositions, and processes related thereto 美国陶氏益农公司 2017-04-19 CN disclosed
CN-106535634-A Molecules having certain pesticidal utility, intermediates, compositions, and methods related thereto 美国陶氏益农公司 2017-03-22 CN disclosed
CN-103826452-B Pesticidal compositions and processes related thereto 陶氏益农公司 2017-02-01 CN disclosed
CN-105209450-A Molecules and intermediates having pesticidal utility, compositions and methods relating thereto DOW AGROSCIENCES LLC 2015-12-30 CN disclosed
CN-104602524-A Pesticidal compositions and methods related thereto DOW AGROSCIENCES LLC 2015-05-06 CN disclosed
WO-2014186027-A1 PROCESS FOR THE PREPARATION OF TRIARYL RHAMNOSE CARBAMATES DOW AGROSCIENCES LLC (US) 2014-11-20 WO disclosed
WO-2014158644-A1 PROCESS FOR THE PREPARATION OF TRIARYL RHAMNOSE CARBAMATES DOW AGROSCIENCES LLC (US) 2014-10-02 WO disclosed
WO-2014158646-A1 IMPROVED PROCESS FOR THE PREPARATION OF CERTAIN TRIARYL RHAMNOSE CARBAMATES DOW AGROSCIENCES LLC (US) 2014-10-02 WO disclosed
WO-2014158650-A1 PREPARATION OF TRIARYL RHAMNOSE CARBAMATES DOW AGROSCIENCES LLC (US) 2014-10-02 WO disclosed
WO-2014158647-A1 PREPARATION OF TRIARYL RHAMNOSE CARBAMATES DOW AGROSCIENCES LLC (US) 2014-10-02 WO disclosed