SCHEMBL1844964

SCHEMBL1844964

CC1(C)Oc2cccc(COC(N)=O)c2O1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.47
CCR8 P51685 1/20 0.40
KCNH2 Q12809 1/20 0.40
MGAM O43451 1/20 0.33
AMY1A P0DUB6 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
MTNR1A P48039 4/20 0.32
ADORA2A P29274 1/20 0.32
HTR1A P08908 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30
PKM P14618 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
GLA P06280 1/20 0.30
MAPT P10636 1/20 0.30
PPARG P37231 1/20 0.30

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
Hydrochloric Acid SCHEMBL27816372 0.99 ALDH1A1 (0.46) ALDH1A1CCR8KCNH2MGAMAMY1A
SCHEMBL12681552 0.76 ALDH1A1 (0.46) ALDH1A1CCR8KCNH2MTNR1AHTR1A
SCHEMBL14612087 0.75 ALDH1A1 (0.51) ALDH1A1CCR8KCNH2GAAMTNR1A
SCHEMBL10696519 0.75 LMNA (0.49) ALDH1A1MAPT
Methyl Carbamate SCHEMBL8767233 0.74 ALDH1A1 (0.52) ALDH1A1CCR8KCNH2GAACYP1A2
SCHEMBL1902846 0.72 ALDH1A1 (0.48) ALDH1A1CCR8KCNH2GAAMTNR1A
SCHEMBL25844904 0.72 ALDH1A1 (0.42) ALDH1A1CCR8KCNH2HTR1A
Hydrochloric Acid SCHEMBL1758051 0.71 ALDH1A1 (0.47) ALDH1A1CCR8KCNH2GAAMTNR1A
SCHEMBL1695785 0.70 ALDH1A1 (0.41) ALDH1A1CCR8KCNH2MTNR1AHTR1A
SCHEMBL29501710 0.70 SMN1; SMN2 (0.48) ALDH1A1CYP1A2CYP2D6PKMSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4191773-A 2,3-(ISOPROPYLIDENEDIOXY)PHENYL-METHYL CARBAMATE AND 2-NITRO-4-CHLOROPHENYL 2-PROPYLNYL ETHER HOFFMANN-LA ROCHE INC. (US) 1980-03-04 US claimed
CN-108935451-B Bendiocarb dry suspending agent and preparation method thereof 青岛润农化工有限公司 2021-07-23 CN disclosed
US-20130273278-A1 AGRICULTURAL CHEMICAL COMPOSITION AND FRUIT BAG NIPPON SODA CO., LTD. (JP) 2013-10-17 US disclosed
US-20110159065-A1 AGRICULTURAL CHEMICAL COMPOSITION AND FRUIT BAG NIPPON SODA CO., LTD. (JP) 2011-06-30 US disclosed
EP-2322037-A1 PESTICIDE COMPOSITION AND FRUIT BAG Nippon Soda Co., Ltd. (JP) 2011-05-18 EP disclosed
CN-101939339-A Detection of biomarkers ATERIS TECHNOLOGIES LLC 2011-01-05 CN disclosed
US-4191773-A 2,3-(ISOPROPYLIDENEDIOXY)PHENYL-METHYL CARBAMATE AND 2-NITRO-4-CHLOROPHENYL 2-PROPYLNYL ETHER HOFFMANN-LA ROCHE INC. (US) 1980-03-04 US disclosed
US-4191773-A 2,3-(ISOPROPYLIDENEDIOXY)PHENYL-METHYL CARBAMATE AND 2-NITRO-4-CHLOROPHENYL 2-PROPYLNYL ETHER HOFFMANN-LA ROCHE INC. (US) 1980-03-04 US disclosed