SCHEMBL6153965

SCHEMBL6153965

CC(C)(C)OC(=O)N[C@H]1CC[C@H](Nc2ccc(C#N)cc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.54
EPHX1 P07099 1/20 0.47
KDM1A O60341 1/20 0.46
MAOB P27338 1/20 0.46
CTSK P43235 2/20 0.46
KCNA3 P22001 1/20 0.46
KDM4D Q6B0I6 1/20 0.46
ALDH1A1 P00352 2/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
EPHX2 P34913 3/20 0.43
CCR6 P51684 1/20 0.43
DRD3 P35462 1/20 0.43

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
SCHEMBL6153963 1.00 DRD2 (0.54) DRD2EPHX1KDM1AMAOBCTSK
SCHEMBL6156811 0.88 BTK (0.51) DRD2EPHX1KDM1AMAOBCTSK
SCHEMBL6156813 0.88 BTK (0.51) DRD2EPHX1KDM1AMAOBCTSK
SCHEMBL1938116 0.83 CCR6 (0.53) DRD2KDM4DCCR6
SCHEMBL23720467 0.83 KDM1A (0.49) DRD2EPHX1KDM1AMAOBALDH1A1
SCHEMBL32665319 0.83 KDM1A (0.49) DRD2EPHX1KDM1AMAOBKCNA3
SCHEMBL31205987 0.83 KDM1A (0.49) DRD2EPHX1KDM1AMAOBKDM4D
SCHEMBL30556445 0.83 KDM1A (0.49) DRD2EPHX1KDM1AMAOBALDH1A1
SCHEMBL25039551 0.83 EPHX2 (0.50) DRD2EPHX1KDM1AMAOBKCNA3
SCHEMBL1101802 0.83 ALDH1A1 (0.52) DRD2EPHX1KDM1AMAOBCTSK

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 DRD2 3058/4885EPHX1 1073/4885KDM1A 728/4885

“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.