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Sugi Predict / Compounds / SCHEMBL9702967

SCHEMBL9702967

SCHEMBL9702967

Nc1ncnc2c1nc(Cl)n2[C@@H]1O[C@H](COP(=O)(O)O)C(O)C1O

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SIRT2 Q8IXJ6 1/20 0.72
▸ SIRT1 Q96EB6 1/20 0.72
▸ ENTPD1 P49961 2/20 0.68
▸ TRPM2 O94759 2/20 0.67
▸ DNPH1 O43598 1/20 0.67
▸ PRKAB2 O43741 1/20 0.67
▸ LDHA P00338 1/20 0.67
▸ ADRB2 P07550 1/20 0.67
▸ FBP1 P09467 1/20 0.67
▸ SRC P12931 1/20 0.67
▸ ADORA1 P30542 1/20 0.67
▸ P2RY2 P41231 1/20 0.67
▸ P2RY1 P47900 1/20 0.67
▸ PRKAG1 P54619 1/20 0.67
▸ PRKAA2 P54646 1/20 0.67
▸ PDE4D Q08499 1/20 0.67
▸ KCNH2 Q12809 1/20 0.67
▸ PRKAA1 Q13131 1/20 0.67
▸ PDE3A Q14432 1/20 0.67
▸ SMN1; SMN2 Q16637 1/20 0.67

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
SCHEMBL9702452 1.00 SIRT2 (0.72) SIRT2SIRT1ENTPD1TRPM2DNPH1
SCHEMBL20277574 1.00 SIRT2 (0.72) SIRT2SIRT1ENTPD1TRPM2DNPH1
SCHEMBL20277592 1.00 SIRT2 (0.72) SIRT2SIRT1ENTPD1TRPM2DNPH1
SCHEMBL19668316 0.93 SIRT2 (0.63) SIRT2SIRT1ENTPD1TRPM2DNPH1
SCHEMBL9752397 0.92 ENTPD1 (0.74) ENTPD1TRPM2P2RY1
SCHEMBL9752399 0.92 ENTPD1 (0.74) ENTPD1TRPM2P2RY1
SCHEMBL30292631 0.92 ENTPD1 (0.76) ENTPD1TRPM2SRCP2RY2P2RY1
SCHEMBL12932272 0.92 ENTPD1 (0.76) ENTPD1TRPM2SRCP2RY2P2RY1
SCHEMBL1062562 0.92 ENTPD1 (0.76) ENTPD1TRPM2SRCP2RY2P2RY1
SCHEMBL31685855 0.90 SIRT2 (0.75) SIRT2SIRT1ENTPD1TRPM2DNPH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11185100-B2 Methods for modulating taste receptors MARS, INCORPORATED (US) 2021-11-30 — — US disclosed
US-20190021380-A1 FLAVOR COMPOSITIONS AND PET FOOD PRODUCTS CONTAINING THE SAME MARS, INCORPORATED (US) 2019-01-24 — — US disclosed
US-20180168208-A1 FLAVOR COMPOSITIONS AND PET FOOD PRODUCTS CONTAINING THE SAME MARS, INCORPORATED (US) 2018-06-21 — — US disclosed
EP-0499291-A1 Treatment of malignant tumours with 8-chloroadenosine 3'-5'-cyclic phosphate, 8-aminoadenosine 3',5'-cyclic phosphate and preparation thereof NUCLEIC ACID RESEARCH INSTITUTE (US) 1992-08-19 — — EP disclosed
EP-0346400-A4 TREATMENT OF MALIGNANT TUMORS WITH 8-CHLOROADENOSINE 3',5'-CYCLIC PHOSPHATE, 8-AMINOADENOSINE 3',5'-CYCLIC PHOSPHATE AND PREPARATION THEREOF — 1990-11-28 — — EP disclosed
EP-0346400-A1 TREATMENT OF MALIGNANT TUMORS WITH 8-CHLOROADENOSINE 3',5'-CYCLIC PHOSPHATE, 8-AMINOADENOSINE 3',5'-CYCLIC PHOSPHATE AND PREPARATION THEREOF NUCLEIC ACID RESEARCH INSTITUTE (US) 1989-12-20 — — EP disclosed
EP-0346400-A1 TREATMENT OF MALIGNANT TUMORS WITH 8-CHLOROADENOSINE 3',5'-CYCLIC PHOSPHATE, 8-AMINOADENOSINE 3',5'-CYCLIC PHOSPHATE AND PREPARATION THEREOF NUCLEIC ACID RESEARCH INSTITUTE (US) 1989-12-20 — — EP disclosed
US-4861873-A 8-Chloroadenosine 3', 5'-cyclic monophosphate preparations NUCLEIC ACID RESEARCH INSTITUTE (US) 1989-08-29 — — US disclosed
WO-1989005648-A1 TREATMENT OF MALIGNANT TUMORS WITH 8-CHLOROADENOSINE 3',5'-CYCLIC PHOSPHATE, 8-AMINOADENOSINE 3',5'-CYCLIC PHOSPHATE AND PREPARATION THEREOF NUCLEIC ACID RESEARCH INSTITUTE (US) 1989-06-29 — — WO disclosed
WO-1989005648-A1 TREATMENT OF MALIGNANT TUMORS WITH 8-CHLOROADENOSINE 3',5'-CYCLIC PHOSPHATE, 8-AMINOADENOSINE 3',5'-CYCLIC PHOSPHATE AND PREPARATION THEREOF NUCLEIC ACID RESEARCH INSTITUTE (US) 1989-06-29 — — WO disclosed