SCHEMBL19082957

SCHEMBL19082957

Cc1nc(NCc2nccnc2C)c2cn[nH]c2n1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.38
LMNA P02545 2/20 0.37
ALDH1A1 P00352 1/20 0.37
PIK3CD O00329 1/20 0.36
PIK3CA P42336 1/20 0.36
PIK3CB P42338 1/20 0.36
PIK3CG P48736 1/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
TSHR P16473 1/20 0.35
HTT P42858 1/20 0.35
PLK4 O00444 9/20 0.35
PAK4 O96013 6/20 0.35
PDPK1 O15530 1/20 0.35
POLB P06746 1/20 0.34

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
SCHEMBL29829565 1.00 CYP1A2 (0.38) CYP1A2LMNAALDH1A1PIK3CDPIK3CA
SCHEMBL19065260 0.87 CYP1A2 (0.37) CYP1A2LMNAALDH1A1PIK3CDPIK3CA
SCHEMBL29829728 0.87 CYP1A2 (0.37) CYP1A2LMNAALDH1A1PIK3CDPIK3CA
SCHEMBL29829404 0.82 ALDH1A1 (0.57) CYP1A2LMNAALDH1A1TSHRHTT
SCHEMBL19082967 0.82 ALDH1A1 (0.57) CYP1A2LMNAALDH1A1TSHRHTT
SCHEMBL17017493 0.80 LMNA (0.42) CYP1A2LMNAALDH1A1PIK3CDPIK3CA
SCHEMBL19064633 0.79 PIK3CA (0.36) ALDH1A1PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL29829148 0.79 PIK3CA (0.36) ALDH1A1PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL19082969 0.78 CLK2 (0.40) LMNATSHRHTT
SCHEMBL17017496 0.76 CYP3A4 (0.46) CYP1A2LMNAALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210107910-A1 Compositions and Methods of Using the Same for Treatment of Neurodegenerative and Mitochondrial Disease MITOKININ, INC. (US) 2021-04-15 US disclosed
US-20210107910-A1 Compositions and Methods of Using the Same for Treatment of Neurodegenerative and Mitochondrial Disease MITOKININ, INC. (US) 2021-04-15 US disclosed
US-10851109-B2 Compositions and methods of using the same for treatment of neurodegenerative and mitochondrial disease MITOKININ LLC (US) 2020-12-01 US disclosed
US-10851109-B2 Compositions and methods of using the same for treatment of neurodegenerative and mitochondrial disease MITOKININ LLC (US) 2020-12-01 US disclosed
US-20190194207-A1 COMPOSITIONS AND METHODS OF USING THE SAME FOR TREATMENT OF NEURODEGENERATIVE AND MITOCHONDRIAL DISEASE MITOKININ INC (US) 2019-06-27 US disclosed
US-10167286-B2 Compositions and methods using the same for treatment of neurodegenerative and mitochondrial disease MITOKININ, INC. (US) 2019-01-01 US disclosed
US-20170190704-A1 COMPOSITIONS AND METHODS USING THE SAME FOR TREATMENT OF NEURODEGENERATIVE AND MITOCHONDRIAL DISEASE Mitokinin, LLC (US) 2017-07-06 US disclosed
US-20170190704-A1 COMPOSITIONS AND METHODS USING THE SAME FOR TREATMENT OF NEURODEGENERATIVE AND MITOCHONDRIAL DISEASE Mitokinin, LLC (US) 2017-07-06 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 (5 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-20210107910-A1 Compositions and Methods of Using the Same for Treatment of Neurodegenerative and Mitochondrial Disease NLN, NME4, COQ8A CYP1A2 3043/4885LMNA 1287/4885ALDH1A1 1829/4885
US-20190194207-A1 COMPOSITIONS AND METHODS OF USING THE SAME FOR TREATMENT OF NEURODEGENERATIVE AND MITOCHONDRIAL DISEASE NLN, HAGH, PDF CYP1A2 3632/4885LMNA 425/4885ALDH1A1 1473/4885
US-10167286-B2 Compositions and methods using the same for treatment of neurodegenerative and mitochondrial disease NLN, NME4, COQ8A CYP1A2 3069/4885LMNA 1217/4885ALDH1A1 1995/4885
US-10851109-B2 Compositions and methods of using the same for treatment of neurodegenerative and mitochondrial disease NLN, NME4, COQ8A CYP1A2 3043/4885LMNA 1287/4885ALDH1A1 1829/4885
US-20170190704-A1 COMPOSITIONS AND METHODS USING THE SAME FOR TREATMENT OF NEURODEGENERATIVE AND MITOCHONDRIAL DISEASE NLN, HAGH, MT-ND2 CYP1A2 4144/4885LMNA 1132/4885ALDH1A1 2073/4885

“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.