SCHEMBL2861080

SCHEMBL2861080

Nc1c2c(=O)[nH]c3ccc(OCCN4CCOCC4)cc3c2nn1-c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 2/20 0.55
PDGFRB P09619 2/20 0.55
KDR P35968 1/20 0.55
PARP1 P09874 2/20 0.51
ADORA2A P29274 2/20 0.47
ADORA1 P30542 2/20 0.47
DRD2 P14416 2/20 0.47
SRC P12931 1/20 0.46
PDGFRA P16234 1/20 0.45
ADORA3 P0DMS8 1/20 0.44
ADORA2B P29275 1/20 0.44
KDM4E B2RXH2 2/20 0.44
MCHR1 Q99705 1/20 0.44
MAPK14 Q16539 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
MAOA P21397 1/20 0.42
LTA4H P09960 2/20 0.42

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
SCHEMBL2864303 0.91 FGFR1 (0.48) FGFR1PDGFRBKDRPARP1ADORA2A
SCHEMBL2857668 0.86 HRH4 (0.45) ADORA2AADORA1DRD2KDM4ENPC1
SCHEMBL2857971 0.84 FGFR1 (0.48) FGFR1PDGFRBKDRADORA2AADORA1
SCHEMBL2868766 0.84 KDM4E (0.51) FGFR1PDGFRBKDRPARP1ADORA2A
SCHEMBL2868613 0.84 FGFR1 (0.49) FGFR1PDGFRBKDRPARP1ADORA2A
SCHEMBL2869046 0.83 RAF1 (0.47) FGFR1PDGFRBKDRKDM4EMCHR1
SCHEMBL2866809 0.82 MCHR1 (0.51) FGFR1PDGFRBKDRSRCKDM4E
SCHEMBL2867564 0.82 DRD2 (0.53) PARP1DRD2ADORA3
SCHEMBL2865177 0.81 FGFR1 (0.45) FGFR1PDGFRBKDRPARP1KDM4E
SCHEMBL2861337 0.81 KDM4E (0.50) FGFR1PDGFRBKDRKDM4ENPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7842701-B2 Pyrazoloquinolone derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-11-30 US disclosed
US-7842701-B2 Pyrazoloquinolone derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-11-30 US disclosed
US-7842701-B2 Pyrazoloquinolone derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-11-30 US disclosed
US-20070281963-A1 Pyrazoloquinolone Derivative And Use Thereof TAKEDA PHARMACEUTICAL COMPANY (JP) 2007-12-06 US disclosed
US-20070281963-A1 Pyrazoloquinolone Derivative And Use Thereof TAKEDA PHARMACEUTICAL COMPANY (JP) 2007-12-06 US disclosed
US-20070281963-A1 Pyrazoloquinolone Derivative And Use Thereof TAKEDA PHARMACEUTICAL COMPANY (JP) 2007-12-06 US disclosed
EP-1719771-A1 PYRAZOLOQUINOLONE DERIVATIVE AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2006-11-08 EP 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-20070281963-A1 Pyrazoloquinolone Derivative And Use Thereof MAP3K20, MAP4K5, MAP4K3 FGFR1 201/4885PDGFRB 375/4885KDR 1226/4885

“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.