SCHEMBL536971

SCHEMBL536971

Nc1ncnc2c1NC=[N+]2

nearest known ligand 0.31

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 3/20 0.31
PI4KA P42356 3/20 0.31
PI4K2B Q8TCG2 3/20 0.31
PI4K2A Q9BTU6 3/20 0.31
PI4KB Q9UBF8 3/20 0.31
XDH P47989 2/20 0.31
RET P07949 2/20 0.31
LMNA P02545 1/20 0.31
DRD3 P35462 1/20 0.31
ERAP1 Q9NZ08 1/20 0.31
CHEK1 O14757 1/20 0.31
DAPK3 O43293 1/20 0.31
PRKD3 O94806 1/20 0.31
MAP4K4 O95819 1/20 0.31
CSF1R P07333 1/20 0.31
FGFR1 P11362 1/20 0.31
FLT1 P17948 1/20 0.31
LTK P29376 1/20 0.31
GRK5 P34947 1/20 0.31
KDR P35968 1/20 0.31

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
SCHEMBL3328965 0.75
SCHEMBL6712707 0.71
SCHEMBL4058597 0.68
SCHEMBL8884946 0.67 KDM4E (0.36)
SCHEMBL3354788 0.67 LRRK2 (0.31) LRRK2PI4KAPI4K2BPI4K2API4KB
SCHEMBL10966100 0.66 HTT (0.43) LRRK2LMNACDK8
SCHEMBL2254848 0.64 DAPK3 (0.33) RETDAPK3PRKD3MAP4K4CSF1R
SCHEMBL14793616 0.64 DAPK3 (0.30) RETDAPK3PRKD3MAP4K4CSF1R
SCHEMBL2255360 0.64 DAPK3 (0.30) RETDAPK3PRKD3MAP4K4CSF1R
SCHEMBL9413248 0.61 RET (0.36) LRRK2PI4KAPI4K2BPI4K2API4KB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024094125-A1 LIPID COMPOUNDS, LIPID NANOPARTICLES, AND PHARMACEUTICAL COMPOSITIONS Shanghai Circode Biomed Co., Ltd. (CN) 2024-05-10 WO claimed
US-11814407-B2 Multiple coupling and oxidation method ROCHE INNOVATION CENTER COPENHAGEN A/S (CH) 2023-11-14 US claimed
US-20230348522-A1 METHOD FOR PRODUCING BICYCLIC PHOSPHORAMIDITE DAIICHI SANKYO COMPANY, LIMITED (JP) 2023-11-02 US claimed
US-20230340008-A1 BRIDGED NUCLEOSIDE AND NUCLEOTIDE USING SAME JAPAN AS REPRESENTED BY DIRECTOR GENERAL OF NATIONAL INSTITUTE OF HEALTH SCIENCES (JP) 2023-10-26 US claimed
WO-2023167094-A1 5'-MODIFIED NUCLEOSIDE AND NUCLEOTIDE USING SAME 国立大学法人大阪大学 2023-09-07 WO claimed
US-20230124641-A1 CROSS-LINKED NUCLEOSIDE AND NUCLEOTIDE USING SAME JAPAN AS REPRESENTED BY DIRECTOR GENERAL OF NATIONAL INSTITUTE OF HEALTH SCIENCES (JP) 2023-04-20 US claimed
US-11566042-B2 Phosphoramidite synthones for the synthesis of self-neutralizing oligonucleotide compounds ZATA Pharmaceuticals, Inc (US) 2023-01-31 US claimed
US-11548910-B2 Oligonucleotide production method NISSAN CHEMICAL CORPORATION (JP) 2023-01-10 US claimed
EP-4108670-A1 BRIDGED NUCLEOSIDE AND NUCLEOTIDE USING SAME OSAKA UNIVERSITY (JP) 2022-12-28 EP claimed
EP-4108262-A1 CROSS-LINKED NUCLEOSIDE AND NUCLEOTIDE USING SAME OSAKA UNIVERSITY (JP) 2022-12-28 EP claimed
EP-0383531-B1 6'-deoxy-6'-halogenoneplanosin A and its production ASAHI CHEMICAL IND (JP) 1994-08-10 EP claimed
EP-0524997-B1 2'-O-ALKYL NUCLEOTIDES AND POLYMERS CONTAINING THEM EUROP LAB MOLEKULARBIOLOG (DE) 1994-08-10 EP claimed
EP-0354246-B1 5'-Phosphonates of 3'-azido-2',3'-dideoxynucleosides INST MOLEKULYARNOI BIOLOG IM V (SU) 1994-03-16 EP claimed
US-5187174-A Biological antigrowth agents ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1993-02-16 US claimed
US-4997928-A DNA sequencing E. I. DU PONT DE NEMOURS AND COMPANY (US) 1991-03-05 US claimed
EP-0383531-A2 6'-deoxy-6'-halogenoneplanosin A and its production ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1990-08-22 EP claimed
EP-0359225-A2 Reagents for the preparation of 5'-tagged oligonucleotides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1990-03-21 EP claimed
EP-0339842-A2 Novel oligoribonucleotide derivatives and application thereof to antiviral agents ISIS PHARMACEUTICALS, INC. (US) 1989-11-02 EP claimed
EP-0285884-A2 Process to produce 2', 3'-Dideoxynucleosides Bristol-Myers Squibb Company (US) 1988-10-12 EP claimed
US-4605659-A HERPES; HEPATITUS SYNTEX (U.S.A.) INC. (US) 1986-08-12 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 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-11566042-B2 Phosphoramidite synthones for the synthesis of self-neutralizing oligonucleotide compounds PNKP, POLI, TYMP LRRK2 2952/4885PI4KA 473/4885PI4K2B 637/4885
US-20230340008-A1 BRIDGED NUCLEOSIDE AND NUCLEOTIDE USING SAME SLC29A1, SLC29A2, PNP LRRK2 4294/4885PI4KA 3060/4885PI4K2B 2971/4885
US-11548910-B2 Oligonucleotide production method RNGTT, OSGEP, PHAX LRRK2 4397/4885PI4KA 1223/4885PI4K2B 1251/4885
US-11814407-B2 Multiple coupling and oxidation method RNGTT, PCNA, TYMP LRRK2 4696/4885PI4KA 984/4885PI4K2B 1137/4885
US-20230124641-A1 CROSS-LINKED NUCLEOSIDE AND NUCLEOTIDE USING SAME RNGTT, NUDT1, SLC29A2 LRRK2 4433/4885PI4KA 2206/4885PI4K2B 2055/4885
US-20230348522-A1 METHOD FOR PRODUCING BICYCLIC PHOSPHORAMIDITE PFAS, ENPP1, NAAA LRRK2 4278/4885PI4KA 933/4885PI4K2B 771/4885

“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.