SCHEMBL709313

SCHEMBL709313

CP(C)c1cc(C(C)(C)C)cc2c1Oc1c(P(C)C)cc(C(C)(C)C)cc1C2(C)C

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 1/20 0.36
GABBR2 O75899 1/20 0.35
GABBR1 Q9UBS5 1/20 0.35

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
SCHEMBL811190 0.79 POLB (0.39) GABBR2GABBR1
SCHEMBL13626850 0.79 DRD1 (0.35) DRD1GABBR2GABBR1
SCHEMBL708320 0.78 DRD1 (0.61) DRD1GABBR2GABBR1
SCHEMBL21327677 0.76 POLB (0.36) GABBR2GABBR1
SCHEMBL14612293 0.76 GABBR2 (0.39) GABBR2GABBR1
SCHEMBL547487 0.76 ALDH1A1 (0.39) GABBR2GABBR1
SCHEMBL708899 0.76 GABBR2 (0.36) GABBR2GABBR1
SCHEMBL31462832 0.76 POLB (0.36) GABBR2GABBR1
SCHEMBL2364662 0.75 DRD1 (0.40) DRD1
SCHEMBL30367805 0.74 GABBR2 (0.37) GABBR2GABBR1

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-8124805-B2 Allyl acetate hydroformylation process LYONDELL CHEMICAL TECHNOLOGY, L.P. (US) 2012-02-28 US disclosed
US-20110124904-A1 Allyl acetate hydroformylation process LYONDELL CHEMICAL TECHNOLOGY, L.P. 2011-05-26 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-20110124904-A1 Allyl acetate hydroformylation process GNPAT, DHPS, ALDH3A1 DRD1 2526/4885GABBR2 1585/4885GABBR1 1972/4885

“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.