SCHEMBL28294840

SCHEMBL28294840

Fc1ccc(C2CC2Cl)cc1C(F)(F)F

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 4/20 0.51
ADRA2A P08913 1/20 0.44
CHRNB2 P17787 1/20 0.44
ADRA2C P18825 1/20 0.44
CHRNB4 P30926 1/20 0.44
CHRNA3 P32297 1/20 0.44
CHRNA7 P36544 1/20 0.44
CHRNA4 P43681 1/20 0.44
TMEM97 Q5BJF2 1/20 0.44
AR P10275 8/20 0.38
HTR2A P28223 2/20 0.37
HTR2C P28335 2/20 0.37
HTR2B P41595 2/20 0.37
FFAR1 O14842 1/20 0.36
ABCC9 O60706 2/20 0.35
ABCC8 Q09428 2/20 0.35
KCNJ11 Q14654 2/20 0.35
KCNJ8 Q15842 2/20 0.35
KCNH2 Q12809 2/20 0.35
KDM1B Q8NB78 1/20 0.35

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
SCHEMBL23993641 0.82 KDM1A (0.51) KDM1AADRA2ACHRNB2ADRA2CCHRNB4
SCHEMBL2359699 0.80 KDM1A (0.46) KDM1AADRA2ACHRNB2ADRA2CCHRNB4
SCHEMBL2359698 0.77 KDM1A (0.46) KDM1AADRA2ACHRNB2ADRA2CCHRNB4
SCHEMBL23995528 0.77 HTR2C (0.47) KDM1AADRA2ACHRNB2ADRA2CCHRNB4
SCHEMBL25004990 0.77 KDM1A (0.46) KDM1AADRA2ACHRNB2ADRA2CCHRNB4
SCHEMBL30946764 0.76 EPHX2 (0.48) KDM1AADRA2ACHRNB2ADRA2CCHRNB4
SCHEMBL29239985 0.76 EPHX2 (0.48) KDM1AADRA2ACHRNB2ADRA2CCHRNB4
SCHEMBL29239984 0.76 EPHX2 (0.48) KDM1AADRA2ACHRNB2ADRA2CCHRNB4
SCHEMBL18161909 0.76 KDM1A (0.43) KDM1AADRA2ACHRNB2ADRA2CCHRNB4
SCHEMBL28294833 0.76 KDM1A (0.43) KDM1AADRA2ACHRNB2ADRA2CCHRNB4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110072842-A Molecules having pesticidal utility, and intermediates, compositions and methods related thereto 美国陶氏益农公司 2019-07-30 CN disclosed
CN-109863131-A Prepare the phenyl that (1R, 3R) -2,2- dihalo -3-(replaces) phenyl that replaces of cyclopropane-carboxylic acid and (1S, 3S) -2,2- dihalo -3-() cyclopropane-carboxylic acid method 美国陶氏益农公司 2019-06-07 CN disclosed