SCHEMBL5240932

SCHEMBL5240932

O=C[C@@H]1CC2C=CC1CC2

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.30
APEX1 P27695 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL718244 1.00 POLB (0.30) POLBAPEX1TDP1
SCHEMBL7710249 0.84 POLB (0.31) POLBAPEX1TDP1
SCHEMBL14457412 0.81
SCHEMBL18885197 0.81
SCHEMBL10139365 0.81
SCHEMBL1269453 0.81
SCHEMBL6160829 0.81
SCHEMBL6159466 0.81
SCHEMBL5434380 0.81
SCHEMBL16704702 0.81

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1263735-B1 ACID ADDITION SALTS OF IMIDAZOLIDINONES AS REACTION CATALYSTS UNIV CALIFORNIA (US) 2007-07-04 EP disclosed
US-6534434-B2 Catalyst for unsaturated carbonyl compounds THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2003-03-18 US disclosed
US-6515137-B2 Enantioselectivity of alpha,beta-unsaturated aldehydes THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2003-02-04 US disclosed
US-6369243-B1 ACID CATALYST THE REGENTS OF THE UNIVERISITY OF CALIFORNIA 2002-04-09 US disclosed
US-20020016473-A1 Catalytic processes employing chiral imidazolidinone-based catalyst composition MACMILLAN DAVID W C (US) 2002-02-07 US disclosed
US-20020013475-A1 Chiral imidazolidinone-based catalyst composition and reaction system MACMILLAN DAVID W C (US) 2002-01-31 US disclosed
US-6307057-B1 CATALYZE ENANTIOSELECTIVE REACTIONS, E.G., DIELS-ALDER REACTIONS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2001-10-23 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-20020013475-A1 Chiral imidazolidinone-based catalyst composition and reaction system COASY, DHPS, INTS9 POLB 1301/4885APEX1 861/4885TDP1 3291/4885
US-20020016473-A1 Catalytic processes employing chiral imidazolidinone-based catalyst composition COASY, ALDH3A1, TALDO1 POLB 502/4885APEX1 423/4885TDP1 2459/4885

“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.