SCHEMBL13603897

SCHEMBL13603897

C=C(CC)COC1CC(=O)Oc2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 9/20 0.38
KMT2A Q03164 9/20 0.38
ALDH1A1 P00352 9/20 0.38
MAPT P10636 6/20 0.38
HPGD P15428 3/20 0.38
TDP1 Q9NUW8 2/20 0.37
USP2 O75604 2/20 0.36
THRB P10828 1/20 0.36
GAA P10253 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TSHR P16473 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
ATM Q13315 1/20 0.34
RECQL P46063 1/20 0.34
APAF1 O14727 1/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 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
SCHEMBL18768279 0.87 MEN1 (0.40) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL18633944 0.77 KMT2A (0.41) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL76686 0.74 ALDH1A1 (0.40) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL12216131 0.71 PKM (0.42) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL12216156 0.71 L3MBTL1 (0.42) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL18898109 0.70 PKM (0.41) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL20691871 0.70 L3MBTL1 (0.39) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL10247821 0.68 ALDH1A1 (0.43) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL8080906 0.66 ALDH1A1 (0.47) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL7113968 0.66 MAOA (0.50) MEN1KMT2AALDH1A1MAPTHPGD

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
US-7638514-B2 Agriculture SYNGENTA CROP PROTECTION, INC. (US) 2009-12-29 US disclosed
US-7638514-B2 Agriculture SYNGENTA CROP PROTECTION, INC. (US) 2009-12-29 US disclosed
US-20070142229-A1 Pesticidally active phenol derivatives SYNGENTA CROP PROTECTION, INC. 2007-06-21 US disclosed
US-20070142229-A1 Pesticidally active phenol derivatives SYNGENTA CROP PROTECTION, INC. 2007-06-21 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-20070142229-A1 Pesticidally active phenol derivatives DDT, QSOX1, CHRM1 MEN1 1465/4885KMT2A 2358/4885ALDH1A1 2993/4885

“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.