SCHEMBL1966046

SCHEMBL1966046

C=CCC1([O])CCCCC1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
ALDH1A1 P00352 1/20 0.34

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
SCHEMBL1965550 0.97
SCHEMBL4965268 0.92
SCHEMBL371283 0.72 POLB (0.33) POLBMEN1KMT2AALDH1A1
SCHEMBL3963259 0.72 POLB (0.33) POLBMEN1KMT2AALDH1A1
SCHEMBL1659297 0.72 POLB (0.33) POLBMEN1KMT2AALDH1A1
SCHEMBL3961575 0.72 POLB (0.33) POLBMEN1KMT2AALDH1A1
SCHEMBL3960623 0.72 POLB (0.33) POLBMEN1KMT2AALDH1A1
SCHEMBL8383848 0.70
SCHEMBL842076 0.70 POLB (0.33) POLBMEN1KMT2AALDH1A1
SCHEMBL3127260 0.69 CYP2C19 (0.36) POLBMEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5959008-A OXYGEN, LIGHT AND/OR HEAT STABILIZERS FOR POLYMERS CIBA SPECIALTY CHEMICALS CORP. (US) 1999-09-28 US claimed
US-20110143939-A1 QUINOXALIN-2-ONE DERIVATIVES, COMPOSITIONS WHICH PROTECT USEFUL PLANTS AND COMPRISE THESE DERIVATIVES, AND PROCESSES FOR THEIR PREPARATION AND THEIR USE BAYER CROPSCIENCE AG (DE) 2011-06-16 US disclosed
US-7332509-B2 Heterocyclic amides, a process for their preparation, compositions comprising them and their use MERIAL LIMITED (US) 2008-02-19 US disclosed
US-20060173022-A1 Heterocyclic amides, method for the production thereof, substances containing said heterocyclic amides, and use thereof as pesticides BAYER CROPSCIENCE GMBH (DE) 2006-08-03 US disclosed
US-20050256000-A1 Quinoxalin-2-one derivatives, compositions which protect useful plants and comprise these derivatives, and processes for their preparation and their use BAYER CROPSCIENCE GMBH (DE) 2005-11-17 US disclosed
US-20040006047-A1 Heterocyclic amides, a process for their preparation, compositions comprising them and their use MERIAL LIMITED 2004-01-08 US disclosed
US-5977132-A GALACTORRHEA, HYPERPROLACTINEMIC OVULATION, PROLACTINOMA AND BRAIN TUMORS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-11-02 US disclosed
US-5959008-A OXYGEN, LIGHT AND/OR HEAT STABILIZERS FOR POLYMERS CIBA SPECIALTY CHEMICALS CORP. (US) 1999-09-28 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 (4 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-20050256000-A1 Quinoxalin-2-one derivatives, compositions which protect useful plants and comprise these derivatives, and processes for their preparation and their use QSOX1, CYC1, CBR3 POLB 2535/4885MEN1 1714/4885KMT2A 3485/4885
US-20110143939-A1 QUINOXALIN-2-ONE DERIVATIVES, COMPOSITIONS WHICH PROTECT USEFUL PLANTS AND COMPRISE THESE DERIVATIVES, AND PROCESSES FOR THEIR PREPARATION AND THEIR USE QSOX1, PRDX2, NQO2 POLB 1994/4885MEN1 1989/4885KMT2A 2197/4885
US-20040006047-A1 Heterocyclic amides, a process for their preparation, compositions comprising them and their use CBR1, HCN1, SCN1A POLB 4168/4885MEN1 1454/4885KMT2A 1571/4885
US-20060173022-A1 Heterocyclic amides, method for the production thereof, substances containing said heterocyclic amides, and use thereof as pesticides CBR3, CBR1, C3AR1 POLB 4212/4885MEN1 2370/4885KMT2A 3980/4885

“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.