SCHEMBL10207870

SCHEMBL10207870

CCc1ccc(-c2ccc(Cl)cc2)cc1C1=C(O)CC(CC2CCOC2)CC1=O

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 1/20 0.34
▸ MAOA P21397 1/20 0.34
▸ MAOB P27338 1/20 0.34
▸ ACACB O00763 2/20 0.34
▸ ACACA Q13085 2/20 0.34
▸ IDH1 O75874 2/20 0.34
▸ HDAC1 Q13547 1/20 0.32
▸ HDAC2 Q92769 1/20 0.32
▸ MDM2 Q00987 3/20 0.32
▸ TP53 P04637 2/20 0.32
▸ CNR1 P21554 1/20 0.32
▸ CNR2 P34972 1/20 0.32
▸ GPR119 Q8TDV5 1/20 0.31
▸ EDNRB P24530 1/20 0.31
▸ EDNRA P25101 1/20 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
SCHEMBL10207887 0.95 KDM1A (0.37) KDM1AMAOAMAOBACACBACACA
SCHEMBL10207868 0.89 ACACB (0.44) KDM1AMAOAMAOBACACBACACA
SCHEMBL10207914 0.87 ACACB (0.33) ACACBACACAEDNRBEDNRA
SCHEMBL12134150 0.86 HDAC1 (0.33) KDM1AMAOAMAOBACACBACACA
SCHEMBL10207888 0.84 ACACB (0.44) KDM1AMAOAMAOBACACBACACA
SCHEMBL12134153 0.83 HDAC1 (0.36) KDM1AMAOAMAOBACACBACACA
SCHEMBL10207903 0.82 MAOA (0.38) KDM1AMAOAMAOBIDH1HDAC1
SCHEMBL468935 0.80 ACACB (0.36) ACACBACACAEDNRBEDNRA
SCHEMBL10207879 0.80 HDAC1 (0.34) KDM1AMAOAMAOBACACBACACA
SCHEMBL10079509 0.79 ACACB (0.33) ACACBACACAEDNRBEDNRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8735322-B2 Herbicides SYNGENTA LIMITED (GB) 2014-05-27 — — US disclosed
US-8735322-B2 Herbicides SYNGENTA LIMITED (GB) 2014-05-27 — — US disclosed
US-20120035053-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-02-09 — — US disclosed
US-20120035053-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-02-09 — — US disclosed
WO-2010046194-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2010-04-29 — — 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-20120035053-A1 NOVEL HERBICIDES DDT, HCAR3, HPD KDM1A 780/4885MAOA 3398/4885MAOB 2839/4885

“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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