SCHEMBL6499952

SCHEMBL6499952

CC(=O)NC1(c2ccc(Cl)cc2)CCN(Cc2ccccc2)CC1

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.67
DRD4 P21917 2/20 0.67
DRD3 P35462 2/20 0.67
POLB P06746 2/20 0.60
CCR3 P51677 1/20 0.60
TACR3 P29371 7/20 0.55
CYP2D6 P10635 1/20 0.52
TACR2 P21452 1/20 0.52
TACR1 P25103 1/20 0.52
ALDH1A1 P00352 2/20 0.50
SIGMAR1 Q99720 1/20 0.50
DPP4 P27487 1/20 0.49
ATM Q13315 1/20 0.49
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL4631243 0.92 POLB (0.64) DRD2DRD4DRD3POLBTACR3
Hydrochloric Acid SCHEMBL9317938 0.91 POLB (0.62) DRD2DRD4DRD3POLBTACR3
SCHEMBL3907536 0.90 POLB (0.60) DRD2DRD4DRD3POLBCCR3
SCHEMBL6496917 0.89 CCR8 (0.61) DRD2DRD4DRD3POLBALDH1A1
SCHEMBL27679274 0.88 POLB (0.58) DRD2DRD4DRD3POLBTACR3
SCHEMBL3905302 0.87 POLB (0.78) DRD2DRD4DRD3POLBTACR3
SCHEMBL3911069 0.86 TACR3 (0.55) DRD2DRD4DRD3POLBCCR3
SCHEMBL19331129 0.85 POLB (0.57) DRD2DRD4DRD3POLBTACR3
SCHEMBL3911046 0.83 POLB (0.61) DRD2DRD4DRD3POLBALDH1A1
SCHEMBL6502713 0.82 CCR8 (0.66) DRD2DRD4DRD3POLBTACR3

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-20050143372-A1 Compounds, pharmaceutical compositions and methods of use therefor MILLENNIUM PHARMACEUTICALS, INC. 2005-06-30 US disclosed
WO-2003037271-A2 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE THEREFOR MILLENNIUM PHARMACEUTICALS,INC. (US) 2003-05-08 WO 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-20050143372-A1 Compounds, pharmaceutical compositions and methods of use therefor CCR8, CCL11, CCR5 DRD2 3014/4885DRD4 3663/4885DRD3 3696/4885

“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.