SCHEMBL7004149

SCHEMBL7004149

CN1CCC(C(=O)NCC2Cc3cccc4c(=O)[nH]c(=O)n(c34)C2)CC1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 4/20 0.42
HTR1A P08908 7/20 0.41
DRD2 P14416 4/20 0.38
DRD3 P35462 4/20 0.38
NAMPT P43490 1/20 0.38
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38
MAPT P10636 1/20 0.37
PARP2 Q9UGN5 2/20 0.37
CCNE2 O96020 1/20 0.36
CDK4 P11802 1/20 0.36
CCND1 P24385 1/20 0.36
CCNE1 P24864 1/20 0.36
CDK2 P24941 1/20 0.36
EPHX2 P34913 1/20 0.36

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
SCHEMBL7009177 0.90 HTR1A (0.42) HTR1ADRD2DRD3MTNR1AMTNR1B
Hydrochloric Acid SCHEMBL7004253 0.89 HTR1A (0.42) PARP1HTR1ADRD2DRD3CCNE2
SCHEMBL7004740 0.88 CHRM4 (0.46) PARP1PARP2
SCHEMBL7008105 0.85 MTNR1A (0.50) HTR1ADRD2DRD3MTNR1AMTNR1B
SCHEMBL7006541 0.79 DRD2 (0.42) PARP1HTR1ADRD2DRD3MTNR1A
SCHEMBL7009570 0.78 ROCK2 (0.42) HTR1AMTNR1AMTNR1BCCNE2CDK4
SCHEMBL7004878 0.78 USP30 (0.42) PARP1HTR1ADRD2DRD3NAMPT
SCHEMBL7003217 0.77 DRD2 (0.41) HTR1ADRD2DRD3NAMPT
SCHEMBL7004557 0.77 CDK4 (0.53) HTR1ADRD2DRD3CCNE2CDK4
SCHEMBL7005191 0.76 PARP1 (0.42) PARP1HTR1ADRD2DRD3NAMPT

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 PARP1 1/4885HTR1A 135/4885DRD2 1008/4885

“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.