SCHEMBL9720681

SCHEMBL9720681

COc1ccccc1N1CCN(Cc2ccc(O)cc2)CC1

nearest known ligand 0.78

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.78
HTR7 P34969 5/20 0.67
DRD4 P21917 4/20 0.66
DRD2 P14416 3/20 0.66
DRD3 P35462 2/20 0.66
ALDH1A1 P00352 2/20 0.64
KDM4E B2RXH2 2/20 0.61
LMNA P02545 1/20 0.61
HTT P42858 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
KMT2A Q03164 1/20 0.60

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
SCHEMBL9225440 0.88 MAPK1 (0.81) MAPK1HTR7DRD4DRD2DRD3
SCHEMBL9720699 0.87 HTR7 (0.65) MAPK1HTR7DRD4DRD2DRD3
SCHEMBL19561754 0.87 MAPK1 (0.80) MAPK1HTR7DRD4DRD2DRD3
SCHEMBL6031726 0.87 MAPK1 (0.80) MAPK1HTR7DRD4DRD2DRD3
SCHEMBL6031061 0.87 MAPK1 (0.80) MAPK1HTR7DRD4DRD2DRD3
SCHEMBL18177886 0.87 MAPK1 (1.00) MAPK1HTR7DRD4DRD2DRD3
Bromide SCHEMBL6575673 0.86 MAPK1 (0.78) MAPK1HTR7DRD4DRD2DRD3
SCHEMBL9720708 0.85 DRD4 (0.73) MAPK1HTR7DRD4DRD2DRD3
SCHEMBL9720648 0.85 HTR7 (0.70) MAPK1HTR7DRD4DRD2DRD3
SCHEMBL9720726 0.85 KDM4E (0.79) MAPK1HTR7DRD4DRD2DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200071735-A1 Compounds for Increasing Lipid Synthesis and Storage WASE, NISHIKANT 2020-03-05 US disclosed
US-20200071735-A1 Compounds for Increasing Lipid Synthesis and Storage WASE, NISHIKANT 2020-03-05 US disclosed
US-10351883-B2 Compounds for increasing lipid synthesis and storage NUTECH VENTURES (US) 2019-07-16 US disclosed
US-10351883-B2 Compounds for increasing lipid synthesis and storage NUTECH VENTURES (US) 2019-07-16 US disclosed
US-20160312253-A1 Compounds for Increasing Lipid Synthesis and Storage INVITROGEN CORPORATION 2016-10-27 US disclosed
US-20160312253-A1 Compounds for Increasing Lipid Synthesis and Storage INVITROGEN CORPORATION 2016-10-27 US disclosed
US-20160312253-A1 Compounds for Increasing Lipid Synthesis and Storage INVITROGEN CORPORATION 2016-10-27 US disclosed
US-5142052-A Cationic effect-driven carbinol/amine reaction LABORATOIRES SYNTEX (FR) 1992-08-25 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-20160312253-A1 Compounds for Increasing Lipid Synthesis and Storage FASN, LIPC, SREBF2 MAPK1 3804/4885HTR7 4140/4885DRD4 3838/4885
US-10351883-B2 Compounds for increasing lipid synthesis and storage FASN, LIPC, SREBF2 MAPK1 3804/4885HTR7 4140/4885DRD4 3838/4885
US-20200071735-A1 Compounds for Increasing Lipid Synthesis and Storage FASN, LIPC, SREBF2 MAPK1 3804/4885HTR7 4140/4885DRD4 3838/4885

“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.