SCHEMBL712814

SCHEMBL712814

CCCN(C)Cc1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.38
MAPT P10636 5/20 0.38
KMT2A Q03164 5/20 0.38
HTT P42858 4/20 0.38
MEN1 O00255 4/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
POLB P06746 1/20 0.38
HPGD P15428 1/20 0.38
MAOA P21397 1/20 0.36
TDP1 Q9NUW8 3/20 0.36
LMNA P02545 2/20 0.36
NSD2 O96028 1/20 0.36
EGFR P00533 1/20 0.36
MAPK1 P28482 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
GAA P10253 1/20 0.36
KDM4E B2RXH2 2/20 0.35
RXFP1 Q9HBX9 1/20 0.35
ADORA2A P29274 2/20 0.35
ADORA1 P30542 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
SCHEMBL711989 0.92 MAPT (0.40) ALDH1A1MAPTKMT2AHTTMEN1
SCHEMBL712224 0.87 MAPT (0.41) ALDH1A1MAPTKMT2AHTTMEN1
SCHEMBL10044133 0.84 MAPT (0.43) ALDH1A1MAPTKMT2AHTTMEN1
SCHEMBL719982 0.84 KMT2A (0.42) ALDH1A1MAPTKMT2AHTTMEN1
SCHEMBL712219 0.84 CYP2D6 (0.48) ALDH1A1SMN1; SMN2POLBHPGDTDP1
SCHEMBL10071932 0.82 TNKS2 (0.47) ALDH1A1MAPTKMT2AHTTMEN1
SCHEMBL714445 0.82 MAPT (0.44) ALDH1A1MAPTKMT2AHTTMEN1
SCHEMBL10044134 0.81 TDP1 (0.37) ALDH1A1MAPTKMT2AHTTMEN1
SCHEMBL12261351 0.81 PARP1 (0.51) ALDH1A1MAPTKMT2AHTTMEN1
SCHEMBL12261358 0.79 PARP1 (0.46) ALDH1A1MAPTKMT2AHTTMEN1

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 ALDH1A1 267/4885MAPT 3490/4885KMT2A 452/4885

“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.