SCHEMBL10195377

SCHEMBL10195377

CCc1ccc(Oc2ccc(Br)cc2[N+](=O)[O-])cc1C1=C(O)C(C)(C)OC(C)(C)C1=O

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 0.38
SMN1; SMN2 Q16637 6/20 0.38
GAA P10253 4/20 0.38
ALDH1A1 P00352 11/20 0.36
MAPT P10636 7/20 0.36
HTT P42858 5/20 0.36
KDM4E B2RXH2 4/20 0.36
HPGD P15428 4/20 0.36
GLA P06280 2/20 0.36
KMT2A Q03164 5/20 0.36
MEN1 O00255 3/20 0.36
THRB P10828 1/20 0.36
MAPK1 P28482 2/20 0.34
HSPB1 P04792 1/20 0.34
POLB P06746 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
NPSR1 Q6W5P4 2/20 0.33
TBXA2R P21731 1/20 0.32

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
SCHEMBL10195340 0.91 ALDH1A1 (0.45) LMNASMN1; SMN2GAAALDH1A1MAPT
SCHEMBL16351664 0.90 ALDH1A1 (0.41) LMNASMN1; SMN2GAAALDH1A1MAPT
SCHEMBL10195393 0.89 HSPB1 (0.43) LMNASMN1; SMN2GAAALDH1A1MAPT
SCHEMBL10195376 0.89 PDE7A (0.44) LMNASMN1; SMN2GAAALDH1A1MAPT
SCHEMBL10195344 0.87 MAPT (0.43) LMNASMN1; SMN2GAAALDH1A1MAPT
SCHEMBL16351689 0.86 ALDH1A1 (0.38) LMNASMN1; SMN2GAAALDH1A1MAPT
SCHEMBL10195081 0.86 MEN1 (0.31) KDM4EKMT2AMEN1MAPK1TDP1
SCHEMBL10195333 0.85 HSPB1 (0.34) LMNASMN1; SMN2GAAALDH1A1MAPT
SCHEMBL10195077 0.85 HTR2A (0.36) LMNASMN1; SMN2ALDH1A1MAPTKDM4E
SCHEMBL10195073 0.85 MAPK14 (0.33) L3MBTL1

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
US-20140378305-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2014-12-25 US disclosed
US-8865623-B2 Herbicidally active cyclic diones and derivatives thereof, processes for their preparation, compositions, and method of controlling weeds SYNGENTA LIMITED (GB) 2014-10-21 US disclosed
US-20120021907-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-01-26 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 (2 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-20140378305-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 LMNA 4151/4885SMN1; SMN2 2218/4885GAA 247/4885
US-20120021907-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 LMNA 4657/4885SMN1; SMN2 2952/4885GAA 478/4885

“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.