SCHEMBL4098956

SCHEMBL4098956

N#Cc1cnc(-c2ccccc2)nc1O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 1/20 0.49
▸ ADORA1 P30542 1/20 0.49
▸ KDR P35968 5/20 0.44
▸ ALDH1A1 P00352 3/20 0.42
▸ NPSR1 Q6W5P4 2/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ NPC1 O15118 3/20 0.42
▸ RAB9A P51151 3/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ NFKB1 P19838 1/20 0.42
▸ NFKB2 Q00653 1/20 0.42
▸ RELA Q04206 1/20 0.42
▸ CDK1 P06493 3/20 0.41
▸ XDH P47989 1/20 0.41
▸ MAPT P10636 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ RECQL P46063 1/20 0.40
▸ KDM4E B2RXH2 3/20 0.39
▸ RXFP1 Q9HBX9 1/20 0.39
▸ ABCG2 Q9UNQ0 1/20 0.39

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
SCHEMBL25301538 0.85 MEN1 (0.45) ALDH1A1NPSR1NPC1RAB9AXDH
SCHEMBL11203920 0.81 ADORA2A (0.68) ADORA2AADORA1KDRALDH1A1RAB9A
SCHEMBL11260015 0.79 ADORA2A (0.57) ADORA2AADORA1KDRALDH1A1NPSR1
SCHEMBL7260003 0.79 NPSR1 (0.54) ADORA2AADORA1KDRALDH1A1NPSR1
SCHEMBL11613419 0.77 KDM4E (0.43) ADORA1ALDH1A1NPSR1NPC1RAB9A
SCHEMBL11607934 0.77 RAB9A (0.41) KDRALDH1A1NPSR1NPC1RAB9A
SCHEMBL16052678 0.77 NPC1 (0.43) ALDH1A1TDP1NPC1RAB9ASMN1; SMN2
SCHEMBL8296347 0.76 ALDH1A1 (0.52) ADORA2AADORA1KDRALDH1A1NPSR1
SCHEMBL2879745 0.76 ADORA2A (0.45) ADORA2AADORA1KDRALDH1A1NPSR1
SCHEMBL2869313 0.76 ADORA2A (0.45) ADORA2AADORA1KDRALDH1A1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090143412-A1 FUROPYRIDINE AND FUROPYRIMIDINE DERIVATIVES FOR THE TREATMENT OF HYPER-PROLIFERATIVE DISORDERS BAYER HEALTHCARE LLC (US) 2009-06-04 — — US disclosed
US-20090143412-A1 FUROPYRIDINE AND FUROPYRIMIDINE DERIVATIVES FOR THE TREATMENT OF HYPER-PROLIFERATIVE DISORDERS BAYER HEALTHCARE LLC (US) 2009-06-04 — — US disclosed
US-20090143412-A1 FUROPYRIDINE AND FUROPYRIMIDINE DERIVATIVES FOR THE TREATMENT OF HYPER-PROLIFERATIVE DISORDERS BAYER HEALTHCARE LLC (US) 2009-06-04 — — US disclosed
US-7429584-B2 Furo[2.3-b]pyridine derivatives for the treatment of hyper-proliferative disorders BAYER PHARMACEUTICALS CORPORATION (US) 2008-09-30 — — US disclosed
US-7429584-B2 Furo[2.3-b]pyridine derivatives for the treatment of hyper-proliferative disorders BAYER PHARMACEUTICALS CORPORATION (US) 2008-09-30 — — US disclosed
US-7429584-B2 Furo[2.3-b]pyridine derivatives for the treatment of hyper-proliferative disorders BAYER PHARMACEUTICALS CORPORATION (US) 2008-09-30 — — US disclosed
EP-1534715-B1 FUROPYRIDINE AND FUROPYRIMIDINE DERIVATIVES FOR THE TREATMENT OF HYPER-PROLIFERATIVE DISORDERS BAYER PHARMACEUTICALS CORP (US) 2007-08-15 — — EP disclosed
US-20060040960-A1 Furopyridine and furopyrimidine derivatives for the treatment of hyper-proliferative disorders BAYER PHARMACEUTICALS CORPORATION (US) 2006-02-23 — — US disclosed
WO-2005087778-A1 TRICYCLIC FUROPYRIDINE DERIVATIVES USEFUL IN THE TREATMENT OF HYPER-PROLIFERATIVE DISORDERS BAYER PHARMACEUTICALS CORPORATION (US) 2005-09-22 — — WO disclosed
EP-1534715-A1 FUROPYRIDINE AND FUROPYRIMIDINE DERIVATIVES FOR THE TREATMENT OF HYPER-PROLIFERATIVE DISORDERS Bayer Pharmaceuticals Corporation (US) 2005-06-01 — — EP disclosed
WO-2004007502-A1 FUROPYRIDINE AND FUROPYRIMIDINE DERIVATIVES FOR THE TREATMENT OF HYPER-PROLIFERATIVE DISORDERS BAYER PHARMACEUTICALS CORPORATION (US) 2004-01-22 — — WO disclosed
US-4517188-A HYPOTENSIVE AGENTS, VASODILATORS, ADRENERGIC BETA BLOCKERS MEAD JOHNSON & COMPANY (US) 1985-05-14 — — 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 (2 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-20090143412-A1 FUROPYRIDINE AND FUROPYRIMIDINE DERIVATIVES FOR THE TREATMENT OF HYPER-PROLIFERATIVE DISORDERS NCOR1, NR3C1, NR3C2 ADORA2A 551/4885ADORA1 306/4885KDR 1402/4885
US-20060040960-A1 Furopyridine and furopyrimidine derivatives for the treatment of hyper-proliferative disorders NR3C1, NR3C2, CCNY ADORA2A 718/4885ADORA1 411/4885KDR 1615/4885

“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.

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