SCHEMBL6914709

SCHEMBL6914709

O=C(CCCN1CCN(C(c2ccccc2)c2ccc(Cl)cc2)CC1)c1ccc2c(c1)CNCCC2

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.52
MCHR1 Q99705 5/20 0.51
DRD3 P35462 10/20 0.50
DRD2 P14416 9/20 0.50
HRH1 P35367 6/20 0.50
HTR2A P28223 4/20 0.50
HTR2B P41595 4/20 0.50
HTR1A P08908 4/20 0.50
HTR7 P34969 4/20 0.50
HTR2C P28335 3/20 0.50
SLC6A2 P23975 1/20 0.48
HRH2 P25021 1/20 0.48
SLC6A4 P31645 1/20 0.48
SLC6A3 Q01959 1/20 0.48
TEK Q02763 1/20 0.48
KCNH2 Q12809 1/20 0.48
USP2 O75604 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
DRD4 P21917 1/20 0.47

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
SCHEMBL6914762 0.95 ACHE (0.54) ACHEMCHR1DRD3DRD2HRH1
SCHEMBL7065256 0.88 TSHR (0.48) ACHEMCHR1DRD3DRD2HRH1
Trifluoroacetic Acid SCHEMBL6803243 0.85 MCHR1 (0.59) ACHEMCHR1DRD3DRD2HRH1
SCHEMBL6917619 0.84 ACHE (0.61) ACHEMCHR1DRD3DRD2HRH1
SCHEMBL5578077 0.84 MCHR1 (0.67) ACHEMCHR1DRD3DRD2HRH1
Hydrochloric Acid SCHEMBL5578192 0.83 MCHR1 (0.66) ACHEMCHR1DRD3DRD2HRH1
SCHEMBL6915567 0.81 DRD3 (0.58) ACHEMCHR1DRD3DRD2HRH1
Hydrochloric Acid SCHEMBL5578160 0.79 DRD2 (0.55) ACHEDRD3DRD2HTR1A
SCHEMBL6918881 0.79 ACHE (0.60) ACHEMCHR1DRD3DRD2HRH1
SCHEMBL5578259 0.77 MCHR1 (0.57) ACHEMCHR1DRD3DRD2HRH1

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-20040063699-A1 Gpr14 antagonist TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-04-01 US disclosed
EP-1310490-A1 GPR14 ANTAGONIST Takeda Chemical Industries, Ltd. (JP) 2003-05-14 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-20040063699-A1 Gpr14 antagonist GPR142, GPR139, GPR4 ACHE 4719/4885MCHR1 191/4885DRD3 433/4885

“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.