SCHEMBL13626850

SCHEMBL13626850

CC(C)(C)c1cc(P(n2cccc2)n2cccc2)c2c(c1)C(C)(C)c1cc(C(C)(C)C)cc(P(n3cccc3)n3cccc3)c1O2

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 1/20 0.35
GABBR2 O75899 1/20 0.31
GABBR1 Q9UBS5 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
SCHEMBL13626861 0.82
SCHEMBL13626875 0.80
SCHEMBL13626860 0.80 DRD1 (0.36) DRD1
SCHEMBL709313 0.79 DRD1 (0.36) DRD1GABBR2GABBR1
SCHEMBL13626849 0.76 DRD1 (0.55) DRD1
SCHEMBL13955180 0.76
SCHEMBL14141464 0.75
SCHEMBL13626889 0.75
SCHEMBL708320 0.75 DRD1 (0.61) DRD1GABBR2GABBR1
SCHEMBL13626881 0.73 DRD1 (0.35) DRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9795952-B2 Bidentate ligands for hydroformylation of ethylene DOW TECHNOLOGY INVESTMENTS LLC (US) 2017-10-24 US disclosed
US-9795952-B2 Bidentate ligands for hydroformylation of ethylene DOW TECHNOLOGY INVESTMENTS LLC (US) 2017-10-24 US disclosed
US-20150328628-A1 Bidentate Ligands for Hydroformylation of Ethylene THE DOW CHEMICAL COMPANY 2015-11-19 US disclosed
US-7615645-B2 Method for the continuous production of aldehydes BASF AKTIENGESELLSCHAFT (DE) 2009-11-10 US disclosed
US-7615645-B2 Method for the continuous production of aldehydes BASF AKTIENGESELLSCHAFT (DE) 2009-11-10 US disclosed
US-20070083066-A1 Method for the production of 1,7-octadiene and use thereof BASF AKTIENGESELLSCHAFT (DE) 2007-04-12 US disclosed
US-20070083066-A1 Method for the production of 1,7-octadiene and use thereof BASF AKTIENGESELLSCHAFT (DE) 2007-04-12 US disclosed
US-7173138-B2 Ligands for pnicogen chelate complexes with a metal of subgroup VIII and use of the complexes as catalysts for hydroformylation, carbonylation, hydrocyanation or hydrogenation BASF AKTIENGESELLSCHAFT (DE) 2007-02-06 US disclosed
US-7173138-B2 Ligands for pnicogen chelate complexes with a metal of subgroup VIII and use of the complexes as catalysts for hydroformylation, carbonylation, hydrocyanation or hydrogenation BASF AKTIENGESELLSCHAFT (DE) 2007-02-06 US disclosed
US-20070004939-A1 Method for the continuous production of aldehydes VOLLAND MARTIN 2007-01-04 US disclosed
US-20070004939-A1 Method for the continuous production of aldehydes VOLLAND MARTIN 2007-01-04 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 (3 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-20070004939-A1 Method for the continuous production of aldehydes HRH4, HRH2, HRH3 DRD1 1338/4885GABBR2 799/4885GABBR1 905/4885
US-20070083066-A1 Method for the production of 1,7-octadiene and use thereof CYP51A1, MSMO1, HSD17B7 DRD1 92/4885GABBR2 2412/4885GABBR1 2192/4885
US-20150328628-A1 Bidentate Ligands for Hydroformylation of Ethylene HRH4, HRH3, H1-4 DRD1 1860/4885GABBR2 1219/4885GABBR1 1464/4885

“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.