SCHEMBL27809588

SCHEMBL27809588

CCCCCCN1C=CN(C)C1Cl

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 3/20 0.34
PTGS2 P35354 3/20 0.34
MGLL Q99685 2/20 0.34
FAAH O00519 1/20 0.34
GUSB P08236 2/20 0.32
EBP Q15125 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
TBXAS1 P24557 1/20 0.32
TSHR P16473 1/20 0.32
THRB P10828 1/20 0.32
NPC1 O15118 5/20 0.32
RAB9A P51151 5/20 0.32
HTT P42858 4/20 0.32
GALR3 O60755 2/20 0.32
POLB P06746 2/20 0.32
ATM Q13315 2/20 0.32
MAPK1 P28482 2/20 0.32
NPSR1 Q6W5P4 2/20 0.32
LMNA P02545 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32

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
SCHEMBL10276249 1.00 PTGS1 (0.34) PTGS1PTGS2MGLLFAAHGUSB
SCHEMBL27931918 1.00 PTGS1 (0.34) PTGS1PTGS2MGLLFAAHGUSB
SCHEMBL27947946 1.00 PTGS1 (0.34) PTGS1PTGS2MGLLFAAHGUSB
SCHEMBL28711787 0.98 PTGS1 (0.31) PTGS1PTGS2MGLLFAAH
SCHEMBL1925361 0.92
SCHEMBL29732297 0.90
Hydrochloric Acid SCHEMBL29049544 0.88
SCHEMBL27763164 0.83
SCHEMBL27711311 0.81 LMNA (0.43) TSHRLMNASMN1; SMN2
SCHEMBL15536440 0.79 PTGS1 (0.36) PTGS1PTGS2MGLLFAAHGUSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113512720-B Copper precipitation pretreatment liquid and pretreatment method thereof 广东硕成科技股份有限公司 2022-06-17 CN claimed
CN-101804304-B Modification method of reverse osmosis membrane surface UNIV BEIJING CHEMICAL 2011-11-09 CN claimed
CN-102432509-B Method for preparing 4-methylsulfonyltoluene UNIV JIAXING 2013-11-13 CN disclosed
CN-102432509-A Method for preparing 4-methylsulfonyl toluene UNIV JIAXING 2012-05-02 CN disclosed
CN-101804304-B Modification method of reverse osmosis membrane surface UNIV BEIJING CHEMICAL 2011-11-09 CN disclosed
CN-101804304-A Modification method of reverse osmosis membrane surface UNIV BEIJING CHEMICAL 2010-08-18 CN disclosed