SCHEMBL7004553

SCHEMBL7004553

CN(C)Cc1ccc(C(=O)NCC2Cc3cccc4c(=O)[nH]c(=O)n(c34)C2)cc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 8/20 0.40
DRD3 P35462 8/20 0.40
HDAC3 O15379 2/20 0.39
HDAC4 P56524 2/20 0.39
HDAC1 Q13547 2/20 0.39
HDAC7 Q8WUI4 2/20 0.39
HDAC2 Q92769 2/20 0.39
HDAC11 Q96DB2 2/20 0.39
HDAC8 Q9BY41 2/20 0.39
HDAC6 Q9UBN7 2/20 0.39
HDAC9 Q9UKV0 2/20 0.39
HDAC5 Q9UQL6 2/20 0.39
LSS P48449 1/20 0.38
HTR1A P08908 6/20 0.37
NAMPT P43490 1/20 0.37
HDAC10 Q969S8 1/20 0.35
PARP1 P09874 2/20 0.35

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
SCHEMBL7003217 0.89 DRD2 (0.41) DRD2DRD3HDAC3HDAC4HDAC1
Hydrochloric Acid SCHEMBL7001226 0.88 HDAC3 (0.41) DRD2DRD3HDAC3HDAC4HDAC1
SCHEMBL7002574 0.87 CTSL (0.44) DRD2DRD3HDAC3HDAC4HDAC1
SCHEMBL7004878 0.84 USP30 (0.42) DRD2DRD3HDAC3HDAC4HDAC1
SCHEMBL7006730 0.84 KDM4E (0.44) DRD2DRD3HTR1ANAMPT
SCHEMBL7008105 0.82 MTNR1A (0.50) DRD2DRD3HTR1A
SCHEMBL7006541 0.81 DRD2 (0.42) DRD2DRD3HTR1APARP1
SCHEMBL7005337 0.80 HTR1A (0.38) DRD2DRD3HTR1APARP1
SCHEMBL7003016 0.80 THRB (0.42) HTR1ANAMPT
SCHEMBL7009570 0.78 ROCK2 (0.42) HTR1A

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-20030105118-A1 Tricyclic quinazolinediones SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2003-06-05 US disclosed
EP-1288216-A1 TRICYCLIC QUINAZOLINEDIONES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2003-03-05 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-20030105118-A1 Tricyclic quinazolinediones PARP1, PARP11, PARP2 DRD2 1008/4885DRD3 878/4885HDAC3 14/4885

“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.