SCHEMBL17734408

SCHEMBL17734408

C#CCC1CC(=O)C(c2c(C)cc(-c3ccc(Cl)cc3)cc2C)C1=O

nearest known ligand 0.31

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ NPC1 O15118 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ ACACB O00763 1/20 0.30
▸ ACACA Q13085 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
SCHEMBL20392789 1.00 ALDH1A1 (0.31) ALDH1A1LMNAHPGDHTTNPSR1
SCHEMBL20392790 1.00 ALDH1A1 (0.31) ALDH1A1LMNAHPGDHTTNPSR1
SCHEMBL17734410 0.88 ACACB (0.31) ALDH1A1LMNAHPGDHTTNPSR1
SCHEMBL16398846 0.88 PYCR1 (0.32) —
SCHEMBL16398717 0.86 ACACB (0.33) ALDH1A1LMNAHPGDHTTNPSR1
SCHEMBL20392603 0.84 GRIA2 (0.36) —
SCHEMBL17734383 0.84 GRIA2 (0.36) —
SCHEMBL16398611 0.84 AHR (0.31) —
SCHEMBL16398208 0.83 ERN1 (0.35) ALDH1A1HPGD
SCHEMBL20392659 0.83 ERN1 (0.35) ALDH1A1HPGD

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-10375956-B2 Herbicidally active 2-(substituted-phenyl)-cyclopentane-1,3-dione compounds and derivatives thereof SYNGENTA LIMITED (GB) 2019-08-13 — — US disclosed
US-20160128326-A1 Herbicidally Active 2-(Substituted-Phenyl)-Cyclopentane-1,3-Dione Compounds and Derivatives Thereof SYNGENTA LIMITED (GB) 2016-05-12 — — 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-20160128326-A1 Herbicidally Active 2-(Substituted-Phenyl)-Cyclopentane-1,3-Dione Compounds and Derivatives Thereof DDT, HDHD5, CNPY2 ALDH1A1 181/4885LMNA 4671/4885HPGD 3062/4885
US-10375956-B2 Herbicidally active 2-(substituted-phenyl)-cyclopentane-1,3-dione compounds and derivatives thereof DDT, HDHD5, CNPY2 ALDH1A1 181/4885LMNA 4671/4885HPGD 3062/4885

“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.

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