SCHEMBL17367355

SCHEMBL17367355

CCOc1cc[n+](-c2nc(N)nc3[nH]cnc23)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.39
LMNA P02545 2/20 0.39
KDM4E B2RXH2 1/20 0.36
HPGD P15428 1/20 0.36
MAPT P10636 4/20 0.36
NPC1 O15118 1/20 0.36
JAK2 O60674 1/20 0.36
HTT P42858 1/20 0.36
RAB9A P51151 1/20 0.36
TDP1 Q9NUW8 2/20 0.35
TSHR P16473 2/20 0.35
ABCB1 P08183 1/20 0.35
TUBB3 Q13509 1/20 0.35
DHFR P00374 1/20 0.33
NQO1 P15559 1/20 0.33
POLB P06746 1/20 0.32
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
KMT2A Q03164 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL17367341 0.83 TTBK1 (0.39) SMN1; SMN2LMNAMAPTNPC1HTT
SCHEMBL17367356 0.79 CA12 (0.33) CA12CA1CA2CA9
Hydrochloric Acid SCHEMBL17364322 0.78 CA12 (0.35) CA12CA1CA2CA9
SCHEMBL8618497 0.73 CDK1 (0.44) CDK1CCNB1CCNA2CDK2CCNA1
SCHEMBL17367351 0.73 SMN1; SMN2 (0.35) SMN1; SMN2LMNAKDM4EHPGDMAPT
SCHEMBL15756598 0.68 ALDH1A1 (0.43) SMN1; SMN2LMNAKDM4EHPGDMAPT
6-Chloroguanine SCHEMBL17187923 0.67 CDK1 (0.39) SMN1; SMN2KDM4EHPGDCDK1CCNB1
SCHEMBL10261053 0.67 NNMT (0.38) SMN1; SMN2MEN1KMT2ANPSR1
2,6-Diaminopurine SCHEMBL5017251 0.67 PDPK1 (0.42) DHFRCDK1CCNB1CCNA2CDK2
SCHEMBL12844134 0.67 HEXA (0.37) SMN1; SMN2LMNATDP1DHFRMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150376219-A1 Selective Preparations of Purine Nucleosides and Nucleotides: Reagents and Methods ZHONG MINGHONG (US) 2015-12-31 US disclosed
US-20150376219-A1 Selective Preparations of Purine Nucleosides and Nucleotides: Reagents and Methods ZHONG MINGHONG (US) 2015-12-31 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-20150376219-A1 Selective Preparations of Purine Nucleosides and Nucleotides: Reagents and Methods PNP, ATIC, NT5C3B SMN1; SMN2 1713/4885LMNA 1004/4885KDM4E 4304/4885

“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.