SCHEMBL6854656

SCHEMBL6854656

CCCOc1c(OC)cc(-c2ccc(C(=O)N3CCN(CCCN4CCN(C(=O)c5ccc(-c6cc(OC)c(OCCC)c(OC)c6)cc5)CC4)CC3)cc2)cc1OC

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 8/20 0.56
DRD3 P35462 6/20 0.53
POLB P06746 1/20 0.53
HPGD P15428 1/20 0.52
HSD17B10 Q99714 1/20 0.52
HRH3 Q9Y5N1 4/20 0.51
HTR2A P28223 1/20 0.51
SLC29A1 Q99808 1/20 0.51
ALDH1A1 P00352 1/20 0.48
HTT P42858 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 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
Hydrochloric Acid SCHEMBL6850866 0.99 DRD2 (0.55) DRD2DRD3POLBHPGDHSD17B10
SCHEMBL6855146 0.91 DRD2 (0.55) DRD2DRD3POLBHPGDHRH3
SCHEMBL5572651 0.89 POLB (0.64) DRD2DRD3POLBHTR2ASLC29A1
Hydrochloric Acid SCHEMBL5570686 0.88 POLB (0.63) DRD2DRD3POLBHTR2ASLC29A1
SCHEMBL6850871 0.87 DRD2 (0.50) DRD2DRD3POLBHPGDHRH3
SCHEMBL5572627 0.87 POLB (0.64) DRD2DRD3POLBHTR2ASLC29A1
SCHEMBL5570688 0.85 SLC29A1 (0.66) DRD2POLBHRH3HTR2ASLC29A1
Hydrochloric Acid SCHEMBL7030279 0.84 POLB (0.62) DRD2DRD3POLBSLC29A1ALDH1A1
SCHEMBL5569613 0.84 POLB (0.67) DRD2DRD3POLBSLC29A1ALDH1A1
Hydrochloric Acid SCHEMBL5573141 0.84 SLC29A1 (0.64) DRD2POLBHPGDHRH3HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6787653-B2 REACTING, IN THE PRESENCE OF A METAL CATALYST, A HALOGENOBENZOIC ACID DERIVATIVE WITH BENZENE DERIVATIVE TO PRODUCE BIPHENYLDICARBOXYLIC ACID AMIDE DERIVATIVE KOWA CO., LTD. (JP) 2004-09-07 US disclosed
WO-2003104213-A1 PREPARATION PROCESS OF BIPHENYLCARBOXYLIC ACID AMIDE DERIVATIVES KOWA CO., LTD. (JP) 2003-12-18 WO disclosed
US-20030232992-A1 Preparation process of biphenylcarboxylic acid amide derivatives KOWA CO., LTD. (JP) 2003-12-18 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 (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-20030232992-A1 Preparation process of biphenylcarboxylic acid amide derivatives CD22, C9, FCGR1A DRD2 1897/4885DRD3 1130/4885POLB 3149/4885

“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.