SCHEMBL15074809

SCHEMBL15074809

CC1(C)c2ccccc2Oc2c(P)cccc21

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 1/20 0.42
AHR P35869 3/20 0.36
ATM Q13315 1/20 0.30
HTR2A P28223 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
SCHEMBL30291735 0.87 DRD1 (0.49) DRD1HTR2A
SCHEMBL9927296 0.87 DRD1 (0.49) DRD1HTR2A
SCHEMBL16773716 0.80 DRD1 (0.44) DRD1AHRHTR2A
SCHEMBL20516731 0.79 DRD1 (0.42) DRD1AHRHTR2A
SCHEMBL31125706 0.79 DRD1 (0.33) DRD1AHR
SCHEMBL47009 0.78 ALOX5 (0.44) DRD1AHRHTR2A
SCHEMBL29360424 0.78 ALOX5 (0.44) DRD1AHRHTR2A
SCHEMBL15982210 0.77 DRD1 (0.41) DRD1AHR
SCHEMBL17856934 0.77 DRD1 (0.41) DRD1AHR
Phosphine SCHEMBL17530281 0.76 ALOX5 (0.42) DRD1AHRHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150025280-A1 LIGANDS FOR RHODIUM CATALYZED REDUCTIVE CARBONYLATION OF ALCOHOLS DOW GLOBAL TECHNOLOGIES LLC (US) 2015-01-22 US disclosed
US-20150025280-A1 LIGANDS FOR RHODIUM CATALYZED REDUCTIVE CARBONYLATION OF ALCOHOLS DOW GLOBAL TECHNOLOGIES LLC (US) 2015-01-22 US disclosed
WO-2013096631-A1 LIGANDS FOR RHODIUM CATALYZED REDUCTIVE CARBONYLATION OF ALCOHOLS DOW GLOBAL TECHNOLOGIES LLC (US) 2013-06-27 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-20150025280-A1 LIGANDS FOR RHODIUM CATALYZED REDUCTIVE CARBONYLATION OF ALCOHOLS ADH5, ADH1C, ADH1A DRD1 873/4885AHR 747/4885ATM 1702/4885

“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.