SCHEMBL5049991

SCHEMBL5049991

CN(C)Cc1c2ccccc2cc2ccccc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.61
MAPT P10636 2/20 0.61
TDP1 Q9NUW8 1/20 0.61
HTR2A P28223 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
ATM Q13315 1/20 0.50
CYP3A4 P08684 2/20 0.48
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
TNNI3 P19429 1/20 0.48
TNNT2 P45379 1/20 0.48
TNNC1 P63316 1/20 0.48
CHRM2 P08172 1/20 0.44
CHRNA7 P36544 1/20 0.44
TNKS O95271 1/20 0.44
CYP2D6 P10635 2/20 0.44
CYP2C19 P33261 2/20 0.44
CYP1A2 P05177 2/20 0.44
ALDH1A1 P00352 4/20 0.43
TSHR P16473 2/20 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
SCHEMBL1975892 0.84 MEN1 (0.64) KDM4EMAPTTDP1ATMCYP3A4
SCHEMBL27082946 0.80 KDM4E (0.58) KDM4EMAPTTDP1L3MBTL1ATM
SCHEMBL2810003 0.79 TSHR (0.53) KDM4EMAPTTDP1HTR2AL3MBTL1
SCHEMBL9138641 0.78 KDM4E (0.66) KDM4EMAPTTDP1ATMCYP3A4
SCHEMBL18503019 0.77 KMT2A (0.47) KDM4EMAPTTDP1HTR2AL3MBTL1
SCHEMBL10645463 0.77 KMT2A (0.53) KDM4EMAPTTDP1HTR2AL3MBTL1
SCHEMBL11299984 0.77 KDM4E (0.47) KDM4EMAPTTDP1ATMKMT2A
SCHEMBL8114346 0.76 KDM4E (1.00) KDM4EMAPTTDP1CYP3A4KMT2A
SCHEMBL12852124 0.76 MEN1 (0.61) KDM4EMAPTTDP1L3MBTL1ATM
Hydrochloric Acid SCHEMBL3620025 0.75 MAPT (0.62) KDM4EMAPTTDP1ATMCYP3A4

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 9 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 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
EP-2000803-A1 Nanoparticles with Polymer Shells Nanosphere, Inc. (US) 2008-12-10 EP disclosed
EP-1135682-B1 NANOPARTICLES WITH POLYMER SHELLS NANOSPHERE INC (US) 2007-07-11 EP disclosed
EP-1135682-A4 NANOPARTICLES WITH POLYMER SHELLS NANOSPHERE INC (US) 2002-09-25 EP disclosed
EP-1135682-A1 NANOPARTICLES WITH POLYMER SHELLS Nanosphere, Inc. (US) 2001-09-26 EP disclosed
WO-2000033079-A1 NANOPARTICLES WITH POLYMER SHELLS NANOSPHERE, INC. (US) 2000-06-08 WO 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 KDM4E 1004/4885MAPT 3490/4885TDP1 522/4885

“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.