SCHEMBL10187580

SCHEMBL10187580

Cc1cc(O)cc(C)c1C1=C(O)C2C3CCC(CC3)C2C1=O

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ELAVL1 Q15717 1/20 0.36
CYP19A1 P11511 1/20 0.33
CYP3A4 P08684 1/20 0.31
CHRM1 P11229 1/20 0.31
ALOX15 P16050 1/20 0.31
MAOA P21397 1/20 0.31
TBXA2R P21731 1/20 0.31
ADRA1A P35348 1/20 0.31
HTR2B P41595 1/20 0.31
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
USP2 O75604 1/20 0.30
MAPT P10636 1/20 0.30
KMT2A Q03164 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
SCHEMBL10187562 0.94 MEN1 (0.35) ELAVL1CYP19A1CYP3A4MEN1KMT2A
SCHEMBL431100 0.90 MEN1 (0.36) HTR2BKDM4EMEN1USP2MAPT
SCHEMBL432186 0.84 SMN1; SMN2 (0.43) CYP3A4KDM4EMEN1MAPTKMT2A
SCHEMBL15800430 0.82 ALDH1A1 (0.32)
SCHEMBL431050 0.77 ALDH1A1 (0.31) MAOA
SCHEMBL432771 0.76 MEN1 (0.32) MEN1KMT2A
SCHEMBL515509 0.76 MAPT (0.33) ELAVL1MAPT
SCHEMBL16281729 0.73 BACE1 (0.38)
SCHEMBL431349 0.72 HTR2A (0.32) HTR2BKDM4EMAPT
SCHEMBL430158 0.72 HTR2A (0.32) HTR2BKDM4EMAPT

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-8680339-B2 Herbicides SYNGENTA LIMITED (GB) 2014-03-25 US disclosed
US-8680339-B2 Herbicides SYNGENTA LIMITED (GB) 2014-03-25 US disclosed
US-20120028800-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-02-02 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-20120028800-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 ELAVL1 2943/4885CYP19A1 74/4885CYP3A4 424/4885

“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.