SCHEMBL9604572

SCHEMBL9604572

CN(C)c1ncnc2c1ncn2C

nearest known ligand 0.69

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.69
CYP2D6 P10635 2/20 0.69
MAPK1 P28482 1/20 0.69
ADORA1 P30542 2/20 0.56
ADORA2A P29274 1/20 0.56
YTHDC1 Q96MU7 1/20 0.53
CYP3A4 P08684 1/20 0.44
PKM P14618 1/20 0.44
NFKB1 P19838 1/20 0.44
THPO P40225 1/20 0.44
PMP22 Q01453 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
SCHEMBL9705702 0.79 CYP1A2 (0.62) CYP1A2CYP2D6MAPK1
SCHEMBL6438354 0.79 ADORA1 (0.54) CYP1A2CYP2D6MAPK1ADORA1ADORA2A
SCHEMBL12498653 0.77 CYP1A2 (0.78) CYP1A2CYP2D6MAPK1ADORA1ADORA2A
SCHEMBL22402771 0.77 CYP1A2 (0.58) CYP1A2CYP2D6MAPK1
SCHEMBL12410753 0.77 PI4KA (0.60) CYP1A2CYP2D6MAPK1
SCHEMBL5015543 0.76 CYP1A2 (0.82) CYP1A2CYP2D6MAPK1ADORA1ADORA2A
SCHEMBL14924510 0.76 CYP1A2 (0.82) CYP1A2CYP2D6MAPK1ADORA1ADORA2A
SCHEMBL13415584 0.76 YTHDC1 (0.45) CYP1A2CYP2D6MAPK1ADORA1ADORA2A
SCHEMBL22399280 0.75 CYP1A2 (0.76) CYP1A2CYP2D6MAPK1ADORA1ADORA2A
SCHEMBL22399527 0.75 CYP1A2 (0.57) CYP1A2CYP2D6MAPK1

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 51 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024119117-A1 MODIFIED 5' CAP FOR MRNA AND METHODS OF USE THEREOF PRIME MEDICINE, INC. (US) 2024-06-06 WO disclosed
US-20240066047-A1 ANTIBODY-DRUG CONJUGATES COMPRISING A CYCLIC DINUCLEOTIDE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2024-02-29 US disclosed
US-20230340485-A1 ANAPLASTIC LYMPHOMA KINASE (ALK) iRNA AGENT COMPOSITIONS AND METHODS OF USE THEREOF ALNYLAM PHARMACEUTICALS, INC. (US) 2023-10-26 US disclosed
US-20230340485-A1 ANAPLASTIC LYMPHOMA KINASE (ALK) iRNA AGENT COMPOSITIONS AND METHODS OF USE THEREOF ALNYLAM PHARMACEUTICALS, INC. (US) 2023-10-26 US disclosed
US-20230295622-A1 COMPOSITIONS AND METHODS FOR SILENCING MYOC EXPRESSION ALNYLAM PHARMACEUTICALS, INC. (US) 2023-09-21 US disclosed
US-20230295622-A1 COMPOSITIONS AND METHODS FOR SILENCING MYOC EXPRESSION ALNYLAM PHARMACEUTICALS, INC. (US) 2023-09-21 US disclosed
US-20230256001-A1 MODIFIED RNA AGENTS WITH REDUCED OFF-TARGET EFFECT ALNYLAM PHARMACEUTICALS, INC. (US) 2023-08-17 US disclosed
US-20230256001-A1 MODIFIED RNA AGENTS WITH REDUCED OFF-TARGET EFFECT ALNYLAM PHARMACEUTICALS, INC. (US) 2023-08-17 US disclosed
US-20230190785-A1 COMPOSITIONS AND METHODS FOR SILENCING DNAJC15 GENE EXPRESSION ALNYLAM PHARMACEUTICALS, INC. (US) 2023-06-22 US disclosed
US-20230190785-A1 COMPOSITIONS AND METHODS FOR SILENCING DNAJC15 GENE EXPRESSION ALNYLAM PHARMACEUTICALS, INC. (US) 2023-06-22 US disclosed
US-20130289013-A1 IMIDAZO[1,2-a]PYRIDINE COMPOUNDS SUNOVION PHARMACEUTICALS INC. 2013-10-31 US disclosed
US-8497278-B2 Imidazo[1,2-a]pyridine compounds SUNOVION PHARMACEUTICALS INC. (US) 2013-07-30 US disclosed
US-8492389-B2 Inhibitors of human phosphatidylinositol 3-kinase delta ICOS CORPORATION (US) 2013-07-23 US disclosed
US-20120289496-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES RHIZEN PHARMACEUTICALS SA (CH) 2012-11-15 US disclosed
US-20120172591-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA ICOS CORPORATION (US) 2012-07-05 US disclosed
US-20120135994-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA ICOS CORPORATION (US) 2012-05-31 US disclosed
US-8138195-B2 Inhibitors of human phosphatidylinositol 3-kinase delta ICOS CORPORATION (US) 2012-03-20 US disclosed
US-20100168139-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA ICOS CORPORATION 2010-07-01 US disclosed
US-20100152211-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA ICOS CORPORATION 2010-06-17 US disclosed
US-20070179100-A1 Protected monomers ALNYLAM PHARMACEUTICALS, INC. 2007-08-02 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 (12 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-20240066047-A1 ANTIBODY-DRUG CONJUGATES COMPRISING A CYCLIC DINUCLEOTIDE STING1, TLR9, CGAS CYP1A2 4509/4885CYP2D6 3736/4885MAPK1 1398/4885
US-20100152211-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA PIK3CD, PIK3CA, PIK3CG CYP1A2 3429/4885CYP2D6 4308/4885MAPK1 154/4885
US-20100168139-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA PIK3CD, PIK3CA, PIK3CG CYP1A2 3429/4885CYP2D6 4308/4885MAPK1 154/4885
US-20120135994-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA PIK3CD, PIK3CA, PIK3CG CYP1A2 3429/4885CYP2D6 4308/4885MAPK1 154/4885
US-20130289013-A1 IMIDAZO[1,2-a]PYRIDINE COMPOUNDS PAICS, ITPA, DPYD CYP1A2 61/4885CYP2D6 23/4885MAPK1 4058/4885
US-20120289496-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES PRKCA, PRKCH, PRKCB CYP1A2 4618/4885CYP2D6 4626/4885MAPK1 185/4885
US-20120172591-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA PIK3CD, PIK3CA, PIK3CG CYP1A2 3429/4885CYP2D6 4308/4885MAPK1 154/4885
US-20230190785-A1 COMPOSITIONS AND METHODS FOR SILENCING DNAJC15 GENE EXPRESSION DNAJC13, DNAJC5, DNAJC7 CYP1A2 4850/4885CYP2D6 4773/4885MAPK1 4193/4885
US-20230256001-A1 MODIFIED RNA AGENTS WITH REDUCED OFF-TARGET EFFECT ADAR, SNRPE, ASGR1 CYP1A2 4790/4885CYP2D6 4728/4885MAPK1 4752/4885
US-20230295622-A1 COMPOSITIONS AND METHODS FOR SILENCING MYOC EXPRESSION MYOF, MYO3A, MYO3B CYP1A2 4880/4885CYP2D6 4874/4885MAPK1 4202/4885
US-20230340485-A1 ANAPLASTIC LYMPHOMA KINASE (ALK) iRNA AGENT COMPOSITIONS AND METHODS OF USE THEREOF ALK, DGKG, EIF2AK2 CYP1A2 4817/4885CYP2D6 4865/4885MAPK1 2634/4885
US-20070179100-A1 Protected monomers PCNA, POLN, PARP1 CYP1A2 2684/4885CYP2D6 3588/4885MAPK1 4090/4885

“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.