SCHEMBL28849481

SCHEMBL28849481

CCCC(C)CC(=O)CO

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.50
CHRM1 P11229 1/20 0.37
AKR1A1 P14550 1/20 0.37
CHRM3 P20309 1/20 0.37
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
ADRA1A P35348 1/20 0.37
HRH1 P35367 1/20 0.37
DRD3 P35462 1/20 0.37
SLC6A3 Q01959 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC2 Q92769 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
CYP3A4 P08684 2/20 0.36
NFKB1 P19838 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
METAP1 P53582 2/20 0.34
HDAC7 Q8WUI4 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33

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
SCHEMBL11559831 0.87 TSHR (0.50) TSHRCHRM1AKR1A1CHRM3HTR2A
SCHEMBL20838323 0.83 TSHR (0.46) TSHRCHRM1AKR1A1CHRM3HTR2A
SCHEMBL26103894 0.82 CES1 (0.42) TSHRACE2ALDH1A1CA1
SCHEMBL8896681 0.81 TSHR (0.44) TSHRCHRM1AKR1A1CHRM3HTR2A
SCHEMBL11405886 0.81 TSHR (0.44) TSHRCHRM1AKR1A1CHRM3HTR2A
SCHEMBL23268059 0.80 TSHR (0.39) TSHRCHRM1AKR1A1CHRM3HTR2A
SCHEMBL11459177 0.79 TSHR (0.42) TSHRCHRM1AKR1A1CHRM3HTR2A
SCHEMBL9172669 0.79 BHMT (0.32) BHMT
SCHEMBL28678686 0.78 TSHR (0.46) TSHRCHRM1AKR1A1CHRM3HTR2A
SCHEMBL6720499 0.78

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-104745693-B Soybean event SYHT0H2 and composition and method for its detection 先正达参股股份有限公司 2017-09-26 CN claimed
CN-108004235-A Soybean event SYHT0H2 and composition and method for its detection 先正达参股股份有限公司 2018-05-08 CN disclosed
CN-103597077-B soybean event SYHT0H2 and compositions and methods for detection thereof 先正达参股股份有限公司 2017-11-07 CN disclosed
CN-104745693-B Soybean event SYHT0H2 and composition and method for its detection 先正达参股股份有限公司 2017-09-26 CN disclosed