SCHEMBL10196017

SCHEMBL10196017

CCc1ccc(Oc2cnc3cc(Cl)ccc3n2)cc1C1=C(O)C2C(C1=O)[C@H]1CC[C@@H]2CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.39
CYP3A4 P08684 2/20 0.39
ALDH1A1 P00352 2/20 0.39
LMNA P02545 2/20 0.39
MAPT P10636 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
TP53 P04637 1/20 0.39
ALOX15 P16050 1/20 0.39
NFKB1 P19838 1/20 0.39
HIF1A Q16665 1/20 0.39
GMNN O75496 1/20 0.39
HPGD P15428 1/20 0.39
APEX1 P27695 1/20 0.39
PMP22 Q01453 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
CYP2C19 P33261 2/20 0.36
CYP2C9 P11712 1/20 0.36
HTT P42858 3/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HRH4 Q9H3N8 2/20 0.31

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
SCHEMBL13190204 0.97 CYP1A2 (0.38) CYP1A2CYP3A4ALDH1A1LMNAMAPT
SCHEMBL10196012 0.97 CYP1A2 (0.38) CYP1A2CYP3A4ALDH1A1LMNAMAPT
SCHEMBL10196282 0.90 HTT (0.36) HTTL3MBTL1
SCHEMBL13190568 0.90 HTT (0.36) HTTL3MBTL1
SCHEMBL19070512 0.90 CYP1A2 (0.40) CYP1A2CYP3A4ALDH1A1LMNAMAPT
SCHEMBL19070998 0.89 HTT (0.41) CYP1A2CYP3A4ALDH1A1LMNAMAPT
SCHEMBL10196268 0.89 HTT (0.41) CYP1A2CYP3A4ALDH1A1LMNAMAPT
SCHEMBL10196184 0.89 CYP1A2 (0.38) CYP1A2CYP3A4ALDH1A1LMNAMAPT
SCHEMBL10196187 0.88 PDE4B (0.32)
SCHEMBL19070647 0.86 ALDH1A1 (0.39) CYP1A2CYP3A4ALDH1A1LMNAMAPT

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-8895474-B2 Herbicidally active cyclopentanediones and derivatives thereof, and their use in controlling weeds SYNGENTA LIMITED (GB) 2014-11-25 US disclosed
US-8895474-B2 Herbicidally active cyclopentanediones and derivatives thereof, and their use in controlling weeds SYNGENTA LIMITED (GB) 2014-11-25 US disclosed
US-20120021912-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 (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-20120021912-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 CYP1A2 67/4885CYP3A4 424/4885ALDH1A1 14/4885

“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.