SCHEMBL10246775

SCHEMBL10246775

Cc1cc(-c2ccccc2)cc(C)c1/C1=C(\O)C[C@H]2C=C[C@H](CC2)CC1=O

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
CNR1 P21554 2/20 0.33
CNR2 P34972 2/20 0.33
BRD4 O60885 1/20 0.33
PPARG P37231 2/20 0.32
PPARA Q07869 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
POLB P06746 1/20 0.30
CRHBP P24387 1/20 0.30
CRHR2 Q13324 1/20 0.30
ABCG2 Q9UNQ0 1/20 0.30
TBXA2R P21731 1/20 0.30
TYMS P04818 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
SCHEMBL13064909 0.83 MAOA (0.34) MAOAMAOBCNR1CNR2TBXA2R
SCHEMBL12134184 0.78 MAOA (0.35) MAOAMAOBCNR1CNR2BRD4
SCHEMBL10207917 0.76 BRD4 (0.34) MAOAMAOBCNR1CNR2BRD4
SCHEMBL430165 0.69 POLB (0.35) MAOAMAOBCNR1CNR2BRD4
SCHEMBL12115775 0.68 BRD4 (0.34) MAOAMAOBCNR1CNR2BRD4
SCHEMBL18971534 0.68 BRD4 (0.34) MAOAMAOBCNR1CNR2BRD4
SCHEMBL10079522 0.67 EHMT2 (0.35) MAOAMAOBBRD4MEN1KMT2A
SCHEMBL13261919 0.66 ELAVL1 (0.36) MAOATBXA2R
SCHEMBL468928 0.66 KCNQ3 (0.33) MAOA
SCHEMBL10207908 0.66 MAOA (0.33) MAOAMAOBBRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120065066-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-03-15 US disclosed
WO-2010133232-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2010-11-25 WO 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-20120065066-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 MAOA 2359/4885MAOB 2064/4885CNR1 935/4885

“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.