SCHEMBL23331997

SCHEMBL23331997

CN(C)c1ccnc2c1ncn2C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 2/20 0.42
ADORA2A P29274 1/20 0.42
YTHDC1 Q96MU7 1/20 0.40
KDM4E B2RXH2 3/20 0.36
ALDH1A1 P00352 2/20 0.36
GLA P06280 1/20 0.36
GAA P10253 1/20 0.36
TSHR P16473 1/20 0.36
CDK1 P06493 3/20 0.35
SMPD3 Q9NY59 1/20 0.35
DYRK1A Q13627 1/20 0.35
GRM1 Q13255 7/20 0.35
HPGD P15428 1/20 0.35
HTT P42858 1/20 0.35
CYP1A2 P05177 2/20 0.34
CYP2D6 P10635 2/20 0.34
MAPK1 P28482 1/20 0.34
GRM5 P41594 3/20 0.34
CDK5 Q00535 1/20 0.33
CYP3A4 P08684 1/20 0.33

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
SCHEMBL23697044 0.80 SMPD3 (0.34) KDM4EALDH1A1SMPD3GRM1HPGD
SCHEMBL25098010 0.80 SMPD3 (0.34) KDM4EALDH1A1SMPD3GRM1HPGD
SCHEMBL10328323 0.77 GRM1 (0.40) KDM4EALDH1A1GRM1HPGDHTT
SCHEMBL24896144 0.77 GRM1 (0.33) KDM4EALDH1A1SMPD3GRM1HPGD
SCHEMBL18510385 0.77 ADORA2A (0.46) ADORA1ADORA2ACDK1DYRK1AGRM1
SCHEMBL26354798 0.77 PI4KA (0.46) KDM4EALDH1A1SMPD3GRM1HPGD
SCHEMBL800728 0.75 ADORA1 (0.46) ADORA1ADORA2AYTHDC1KDM4EALDH1A1
SCHEMBL17741050 0.73 ADORA1 (0.44) ADORA1ADORA2AYTHDC1KDM4EALDH1A1
SCHEMBL16247699 0.73 ADORA1 (0.44) ADORA1ADORA2AYTHDC1KDM4EALDH1A1
SCHEMBL17729177 0.73 CDK1 (0.44) ADORA1ADORA2AYTHDC1KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
WO-2023108020-A2 iRNA COMPOSITIONS AND METHODS FOR SILENCING MYLIP ALNYLAM PHARMACEUTICALS, INC. (US) 2023-06-15 WO disclosed
US-11649459-B2 Superoxide dismutase 1 (SOD1) iRNA compositions and methods of use thereof for treating or preventing superoxide dismutase 1-(SOD1-) associated neurodegenerative diseases ALNYLAM PHARMACEUTICALS, INC. (US) 2023-05-16 US disclosed
WO-2021102373-A1 ATAXIN3 (ATXN3) RNAI AGENT COMPOSITIONS AND METHODS OF USE THEREOF ALNYLAM PHARMACEUTICALS, INC. (US) 2021-05-27 WO disclosed
WO-2021087325-A1 COMPOSITIONS AND METHODS FOR SILENCING DNAJB1-PRKACA FUSION GENE EXPRESSION ALNYLAM PHARMACEUTICALS, INC. (US) 2021-05-06 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 (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-20230190785-A1 COMPOSITIONS AND METHODS FOR SILENCING DNAJC15 GENE EXPRESSION DNAJC13, DNAJC5, DNAJC7 ADORA1 4768/4885ADORA2A 4545/4885YTHDC1 433/4885
US-20230256001-A1 MODIFIED RNA AGENTS WITH REDUCED OFF-TARGET EFFECT ADAR, SNRPE, ASGR1 ADORA1 483/4885ADORA2A 270/4885YTHDC1 1368/4885
US-20230295622-A1 COMPOSITIONS AND METHODS FOR SILENCING MYOC EXPRESSION MYOF, MYO3A, MYO3B ADORA1 4464/4885ADORA2A 4083/4885YTHDC1 150/4885
US-20230340485-A1 ANAPLASTIC LYMPHOMA KINASE (ALK) iRNA AGENT COMPOSITIONS AND METHODS OF USE THEREOF ALK, DGKG, EIF2AK2 ADORA1 3226/4885ADORA2A 2111/4885YTHDC1 2296/4885
US-11649459-B2 Superoxide dismutase 1 (SOD1) iRNA compositions and methods of use thereof for treating or preventing superoxide dismutase 1-(SOD1-) associated neurodegenerative diseases SOD1, SOD3, SMN1; SMN2 ADORA1 1554/4885ADORA2A 987/4885YTHDC1 3887/4885

“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.