SCHEMBL709870

SCHEMBL709870

CCP(CC)c1cccc2c1Oc1c(P(CC)CC)cccc1C2(C)C

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 2/20 0.58
PDK2 Q15119 1/20 0.31
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
SCHEMBL29867917 1.00 DRD1 (0.58) DRD1PDK2HTR2A
SCHEMBL20661508 0.83 DRD1 (0.53) DRD1
SCHEMBL4448167 0.83 DRD1 (0.46) DRD1
SCHEMBL709261 0.79 DRD1 (0.64) DRD1
SCHEMBL29867522 0.79 DRD1 (0.64) DRD1
SCHEMBL24469061 0.79 DRD1 (0.51) DRD1
SCHEMBL9000104 0.78 DRD1 (0.54) DRD1HTR2A
SCHEMBL31738206 0.78 DRD1 (0.54) DRD1HTR2A
SCHEMBL21374252 0.78 DRD1 (0.62) DRD1
SCHEMBL15871415 0.78 DRD1 (0.62) 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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4320092-A1 METHYLCYCLOHEXANE AS ALLYL ALCOHOL HYDROFORMYLATION SOLVENT Lyondell Chemical Technology, L.P. (US) 2024-02-14 EP claimed
US-11613510-B2 Methylcyclohexane as allyl alcohol hydroformylation solvent LYONDELL CHEMICAL TECHNOLOGY, L.P. (US) 2023-03-28 US claimed
US-20220324782-A1 METHYLCYCLOHEXANE AS ALLYL ALCOHOL HYDROFORMYLATION SOLVENT LYONDELL CHEMICAL TECHNOLOGY, L.P. (US) 2022-10-13 US claimed
WO-2022216938-A1 METHYLCYCLOHEXANE AS ALLYL ALCOHOL HYDROFORMYLATION SOLVENT LYONDELL CHEMICAL TECHNOLOGY, L.P. (US) 2022-10-13 WO claimed
US-7612241-B1 Hydroformylation process LYONDELL CHEMICAL TECHNOLOGY, L.P. (US) 2009-11-03 US claimed
EP-4320092-A1 METHYLCYCLOHEXANE AS ALLYL ALCOHOL HYDROFORMYLATION SOLVENT Lyondell Chemical Technology, L.P. (US) 2024-02-14 EP disclosed
US-11613510-B2 Methylcyclohexane as allyl alcohol hydroformylation solvent LYONDELL CHEMICAL TECHNOLOGY, L.P. (US) 2023-03-28 US disclosed
WO-2022216938-A1 METHYLCYCLOHEXANE AS ALLYL ALCOHOL HYDROFORMYLATION SOLVENT LYONDELL CHEMICAL TECHNOLOGY, L.P. (US) 2022-10-13 WO disclosed
US-20220324782-A1 METHYLCYCLOHEXANE AS ALLYL ALCOHOL HYDROFORMYLATION SOLVENT LYONDELL CHEMICAL TECHNOLOGY, L.P. (US) 2022-10-13 US disclosed
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
US-7612241-B1 Hydroformylation process LYONDELL CHEMICAL TECHNOLOGY, L.P. (US) 2009-11-03 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-11613510-B2 Methylcyclohexane as allyl alcohol hydroformylation solvent ADH1C, ADH5, ADH1A DRD1 293/4885PDK2 147/4885HTR2A 362/4885
US-20110124904-A1 Allyl acetate hydroformylation process GNPAT, DHPS, ALDH3A1 DRD1 2526/4885PDK2 121/4885HTR2A 3011/4885
US-20220324782-A1 METHYLCYCLOHEXANE AS ALLYL ALCOHOL HYDROFORMYLATION SOLVENT ADH1C, ADH5, ADH1A DRD1 293/4885PDK2 147/4885HTR2A 362/4885

“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.