SCHEMBL6154811

SCHEMBL6154811

COc1c(C(N)=O)ccc(NC2CCN(Cc3ccccc3)CC2)c1Cl

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A12 P48065 1/20 0.56
SIGMAR1 Q99720 8/20 0.54
KDM4E B2RXH2 1/20 0.54
HSD17B10 Q99714 1/20 0.54
DRD2 P14416 2/20 0.52
DRD4 P21917 2/20 0.52
DRD3 P35462 2/20 0.52
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
ADRA2A P08913 1/20 0.52
CYP2D6 P10635 1/20 0.52
CYP2C9 P11712 1/20 0.52
ADRA2B P18089 1/20 0.52
ADRA2C P18825 1/20 0.52
ACHE P22303 1/20 0.52
SLC6A2 P23975 1/20 0.52
HTR2A P28223 1/20 0.52
HTR2C P28335 1/20 0.52
ADRA1A P35348 1/20 0.52
OPRK1 P41145 1/20 0.52

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
SCHEMBL6156084 0.81 DRD4 (0.68) DRD2DRD4DRD3CYP1A2CYP3A4
SCHEMBL444689 0.80 KDM4E (0.62) SIGMAR1KDM4EHSD17B10DRD2DRD4
Hydrochloric Acid SCHEMBL6154218 0.80 DRD4 (0.67) DRD2DRD4DRD3CYP1A2CYP3A4
SCHEMBL6153565 0.79 SIGMAR1 (0.59) SIGMAR1KDM4EHSD17B10DRD2DRD4
SCHEMBL6154073 0.79 DRD4 (0.58) SLC6A12SIGMAR1DRD2DRD4DRD3
SCHEMBL6153691 0.78 MCHR1 (0.60) SLC6A12SIGMAR1DRD2DRD4DRD3
SCHEMBL6154327 0.78 HTR4 (0.44) DRD4KCNH2
SCHEMBL6154421 0.78 ALDH1A1 (0.54)
SCHEMBL12279961 0.77 JAK2 (0.61) SLC6A12SIGMAR1KDM4E
SCHEMBL6153502 0.75 OPRK1 (0.59) SLC6A12SIGMAR1KDM4EDRD4CYP1A2

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-20050182040-A1 Benzamide derivatives DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2005-08-18 US disclosed
EP-1500643-A1 BENZAMIDE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2005-01-26 EP 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-20050182040-A1 Benzamide derivatives ROCK1, ROCK2, NHERF1 SLC6A12 567/4885SIGMAR1 695/4885KDM4E 2017/4885

“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.