SCHEMBL21164707

SCHEMBL21164707

CCOc1ccc(CN2CCN(c3ccccc3OC)CC2)cc1

nearest known ligand 0.76

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 4/20 0.76
DRD2 P14416 4/20 0.76
DRD3 P35462 3/20 0.76
MAPK1 P28482 2/20 0.72
KDM4E B2RXH2 3/20 0.70
ALDH1A1 P00352 3/20 0.70
KMT2A Q03164 1/20 0.70
ADRA1D P25100 1/20 0.63
ADRA1A P35348 1/20 0.63
ADRA1B P35368 1/20 0.63
HTR7 P34969 2/20 0.62
TSHR P16473 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 0.85 MAPK1 (0.81) DRD4DRD2DRD3MAPK1KDM4E
SCHEMBL18177900 0.84 DRD2 (0.61) DRD4DRD2DRD3MAPK1KDM4E
SCHEMBL6031061 0.84 MAPK1 (0.80) DRD4DRD2DRD3MAPK1KDM4E
SCHEMBL6031726 0.84 MAPK1 (0.80) DRD4DRD2DRD3MAPK1KDM4E
SCHEMBL19561754 0.84 MAPK1 (0.80) DRD4DRD2DRD3MAPK1KDM4E
SCHEMBL18177886 0.84 MAPK1 (1.00) DRD4DRD2DRD3MAPK1KDM4E
SCHEMBL9720681 0.83 MAPK1 (0.78) DRD4DRD2DRD3MAPK1KDM4E
Bromide SCHEMBL6575673 0.83 MAPK1 (0.78) DRD4DRD2DRD3MAPK1KDM4E
SCHEMBL1114497 0.83 DRD2 (0.72) DRD4DRD2DRD3MAPK1KDM4E
SCHEMBL8646219 0.82 MAPK1 (0.72) DRD4DRD2DRD3MAPK1KDM4E

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-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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-10351883-B2 Compounds for increasing lipid synthesis and storage FASN, LIPC, SREBF2 DRD4 3838/4885DRD2 4274/4885DRD3 4217/4885
US-20200071735-A1 Compounds for Increasing Lipid Synthesis and Storage FASN, LIPC, SREBF2 DRD4 3838/4885DRD2 4274/4885DRD3 4217/4885

“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.