SCHEMBL28259121

SCHEMBL28259121

O=C(NC1CCN(CC(F)(F)F)CC1)c1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 9/20 0.69
KDM1A O60341 2/20 0.66
CARM1 Q86X55 1/20 0.64
PRMT6 Q96LA8 1/20 0.64
ADRA1D P25100 1/20 0.61
ADRA1A P35348 1/20 0.61
ADRA1B P35368 1/20 0.61
MCHR1 Q99705 3/20 0.60
SLC6A12 P48065 1/20 0.60
TMEM97 Q5BJF2 1/20 0.60
SIGMAR1 Q99720 1/20 0.60
POLB P06746 1/20 0.60
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
CCR3 P51677 1/20 0.57

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
SCHEMBL1367082 0.85 HPGDS (0.78) HPGDSKDM1ACARM1PRMT6MCHR1
SCHEMBL2071021 0.83 HPGDS (1.00) HPGDSKDM1AMCHR1SLC6A12TMEM97
SCHEMBL14067116 0.82 CARM1 (0.70) CARM1PRMT6ADRA1DADRA1AADRA1B
SCHEMBL18286474 0.81 CARM1 (0.72) HPGDSCARM1PRMT6ADRA1DADRA1A
SCHEMBL27713189 0.81 MEN1 (0.58) CARM1PRMT6ADRA1DADRA1AADRA1B
SCHEMBL3650292 0.81 CARM1 (0.68) CARM1PRMT6ADRA1DADRA1AADRA1B
SCHEMBL17011805 0.80 KDM1A (1.00) HPGDSKDM1A
SCHEMBL1367026 0.80 HPGDS (0.65) HPGDSKDM1A
SCHEMBL1367299 0.80 HPGDS (0.65) HPGDSKDM1AMCHR1SLC6A12TMEM97
SCHEMBL17003376 0.80 KDM1A (0.78) HPGDSKDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106165684-B Pesticidal compositions and methods relating thereto 陶氏益农公司 2019-06-14 CN disclosed
CN-105025715-B Pesticidal compositions and methods related thereto 美国陶氏益农公司 2018-11-16 CN disclosed
CN-104981160-B Pesticidal compositions and methods related thereto 美国陶氏益农公司 2018-04-20 CN disclosed
CN-104981154-B Pesticidal compositions and methods related thereto 美国陶氏益农公司 2018-01-26 CN disclosed