SCHEMBL28035666

SCHEMBL28035666

CCCCOCCOC(=O)CCCl

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.55
DNM1 Q05193 1/20 0.42
TSHR P16473 2/20 0.42
NAAA Q02083 1/20 0.41
CYP3A4 P08684 1/20 0.41
HTR2C P28335 1/20 0.41
EPHX2 P34913 1/20 0.41
ALDH1A1 P00352 2/20 0.41
RARB P10826 1/20 0.40
ATM Q13315 1/20 0.38
MEN1 O00255 1/20 0.38
THRB P10828 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
MAPT P10636 1/20 0.38
PAM P19021 2/20 0.38
LMNA P02545 1/20 0.38
MGLL Q99685 1/20 0.37

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
SCHEMBL1302517 0.88 DGKA (0.63) DGKADNM1TSHRNAAACYP3A4
SCHEMBL16837163 0.88 DGKA (0.63) DGKADNM1TSHRNAAACYP3A4
SCHEMBL1365902 0.88 DGKA (0.57) DGKADNM1TSHRNAAAHTR2C
SCHEMBL17375071 0.88 DGKA (0.63) DGKADNM1TSHRNAAACYP3A4
SCHEMBL21299155 0.87 DGKA (0.47) DGKADNM1TSHRNAAACYP3A4
SCHEMBL9839988 0.86 DGKA (0.73) DGKADNM1TSHRNAAACYP3A4
SCHEMBL181591 0.86 DGKA (0.61) DGKADNM1TSHRNAAACYP3A4
SCHEMBL16631960 0.86 DGKA (0.61) DGKADNM1TSHRNAAACYP3A4
SCHEMBL439161 0.86 DGKA (0.73) DGKADNM1TSHRNAAACYP3A4
SCHEMBL8172950 0.86 DGKA (0.67) DGKADNM1TSHRNAAACYP3A4

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-111328327-A 1- (N, N-disubstituted carbamoyl) 4- (substituted sulfonyl) triazolin-5-one derivatives, 4- (N, N-disubstituted carbamoyl) 1- (substituted sulfonyl) triazolin-5-one derivatives and herbicides containing these derivatives as active ingredients 北兴化学工业株式会社 2020-06-23 CN disclosed
CN-105658060-B Herbicidal combinations 石原产业株式会社 2018-01-30 CN disclosed
CN-107072209-A Herbicidal composition 石原产业株式会社 2017-08-18 CN disclosed
CN-104994737-B Herbicidal combination for tolerant soybean cultigen 拜尔农作物科学股份公司 2017-08-11 CN disclosed
CN-105377038-B Method for producing trans-bis(aminomethyl)cyclohexane, method for producing bis(isocyanatomethyl)cyclohexane, bis(isocyanatomethyl)cyclohexane, polyisocyanate composition, and polyurethane resin 石原产业株式会社 2017-03-22 CN disclosed
CN-104994737-A Herbicidal combinations for tolerant soybean cultures BAYER CROPSCIENCE AG 2015-10-21 CN disclosed