SCHEMBL7607612

SCHEMBL7607612

COc1cccc(OC2C=CC(=O)O2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.41
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
SLC6A3 Q01959 1/20 0.40
LMNA P02545 2/20 0.38
ACHE P22303 1/20 0.38
ROCK2 O75116 1/20 0.38
CES2 O00748 1/20 0.38
CES1 P23141 1/20 0.38
MEN1 O00255 2/20 0.37
POLB P06746 2/20 0.37
KMT2A Q03164 2/20 0.37
ALDH1A1 P00352 2/20 0.37
CYP3A4 P08684 2/20 0.37
KDM4E B2RXH2 1/20 0.37
NPC1 O15118 1/20 0.37
CYP2D6 P10635 1/20 0.37
NFKB1 P19838 1/20 0.37
CYP2C19 P33261 1/20 0.37
HTT P42858 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
SCHEMBL6332220 0.80 CTSV (0.36) MGLLSLC6A2SLC6A4SLC6A3LMNA
SCHEMBL980478 0.69
1,3-Dimethoxybenzene SCHEMBL9350 0.69 ACHE (0.70) LMNAACHECES2CES1ALDH1A1
1,3-Dimethoxybenzene SCHEMBL901285 0.69 ACHE (0.70) LMNAACHECES2CES1ALDH1A1
1,3-Dimethoxybenzene SCHEMBL27703685 0.67 ACHE (0.61) MGLLLMNAACHECES2CES1
1,3-Dimethoxybenzene SCHEMBL15870025 0.66 ACHE (0.67) LMNAACHECES2CES1ALDH1A1
1,3-Dimethoxybenzene SCHEMBL28542304 0.66 ACHE (0.67) LMNAACHECES2CES1ALDH1A1
1,3-Dimethoxybenzene SCHEMBL28262290 0.66 ACHE (0.67) LMNAACHECES2CES1ALDH1A1
1,3-Dimethoxybenzene SCHEMBL7860661 0.66 ACHE (0.67) LMNAACHECES2CES1ALDH1A1
1,3-Dimethoxybenzene SCHEMBL28343465 0.66 ACHE (0.67) LMNAACHECES2CES1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111533715-B 2(5H) -furan-2-one derivative, preparation method thereof and application thereof in inhibiting rice tillering 南京农业大学 2021-04-06 CN disclosed
CN-111533715-A 2(5H) -furan-2-one derivative, preparation method thereof and application thereof in inhibiting rice tillering 南京农业大学 2020-08-14 CN disclosed
US-20020052323-A1 Quinoline-(C=O)-(multiple amino acids)-leaving group compounds for pharmaceutical compositions and reagents MP BIOMEDICALS, LLC 2002-05-02 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020052323-A1 Quinoline-(C=O)-(multiple amino acids)-leaving group compounds for pharmaceutical compositions and reagents CASP3, CASP1, BAX MGLL 2373/4885SLC6A2 2405/4885SLC6A4 2535/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.