SCHEMBL713737

SCHEMBL713737

COc1cccc(N2CCN(Cc3nc4ccc5c(c4[nH]3)C(=O)c3ccccc3C5=O)CC2)c1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 4/20 0.62
LMNA P02545 2/20 0.53
MAPT P10636 2/20 0.53
TSHR P16473 2/20 0.51
GAA P10253 1/20 0.51
HSD17B10 Q99714 1/20 0.51
HTR1A P08908 5/20 0.47
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
GFER P55789 1/20 0.44
DRD2 P14416 1/20 0.44
HTR2A P28223 1/20 0.44
HTR7 P34969 1/20 0.44
HTR6 P50406 1/20 0.44

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
SCHEMBL719451 0.88 DRD4 (0.56) DRD4LMNAMAPTTSHRGAA
SCHEMBL716624 0.81 GAA (0.47) DRD4MAPTTSHRGAAHSD17B10
SCHEMBL710529 0.81 ADORA2A (0.45) LMNAMAPTTSHRGAAALDH1A1
SCHEMBL712030 0.80 DRD4 (0.57) DRD4MAPTHTR1AKDM4EALDH1A1
SCHEMBL719983 0.79 L3MBTL1 (0.54) DRD4MAPTTSHRGAAHSD17B10
SCHEMBL713856 0.79 HTT (0.52) MAPTGAAHSD17B10KDM4EALDH1A1
SCHEMBL713735 0.79 HTT (0.52) MAPTGAAHSD17B10KDM4EALDH1A1
SCHEMBL714240 0.78 TERT (0.51) DRD4MAPTGAAKDM4EALDH1A1
SCHEMBL709933 0.78 DRD4 (0.59) DRD4MAPTTSHRGAAKDM4E
SCHEMBL712167 0.78 DRD4 (0.59) DRD4MAPTHSD17B10HTR1AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8124637-B2 Anthra [1, 2-d]imidazole-6,11-dione derivatives, preparation method and application thereof NATIONAL DEFENSE MEDICAL CENTER (TW) 2012-02-28 US claimed
US-8124637-B2 Anthra [1, 2-d]imidazole-6,11-dione derivatives, preparation method and application thereof NATIONAL DEFENSE MEDICAL CENTER (TW) 2012-02-28 US disclosed
US-8124637-B2 Anthra [1, 2-d]imidazole-6,11-dione derivatives, preparation method and application thereof NATIONAL DEFENSE MEDICAL CENTER (TW) 2012-02-28 US disclosed
US-8124637-B2 Anthra [1, 2-d]imidazole-6,11-dione derivatives, preparation method and application thereof NATIONAL DEFENSE MEDICAL CENTER (TW) 2012-02-28 US disclosed
US-20110207719-A1 Novel Anthra [1, 2-d]imidazole-6,11-dione Derivatives, Preparation Method and application thereof NATIONAL DEFENSE MEDICAL CENTER (TW) 2011-08-25 US disclosed
US-20110207719-A1 Novel Anthra [1, 2-d]imidazole-6,11-dione Derivatives, Preparation Method and application thereof NATIONAL DEFENSE MEDICAL CENTER (TW) 2011-08-25 US disclosed
US-20110207719-A1 Novel Anthra [1, 2-d]imidazole-6,11-dione Derivatives, Preparation Method and application thereof NATIONAL DEFENSE MEDICAL CENTER (TW) 2011-08-25 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-20110207719-A1 Novel Anthra [1, 2-d]imidazole-6,11-dione Derivatives, Preparation Method and application thereof TERT, ACIN1, AK2 DRD4 4382/4885LMNA 543/4885MAPT 3490/4885

“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.