SCHEMBL2861595

SCHEMBL2861595

Nc1c2c(=O)[nH]c3cc(OCCCN4CCOCC4)ccc3c2nn1-c1ccc(OC2CCCC2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 2/20 0.43
KDR P35968 2/20 0.43
PDGFRB P09619 1/20 0.43
KDM4E B2RXH2 1/20 0.40
MAOA P21397 1/20 0.40
BMPR1B O00238 1/20 0.40
BMPR1A P36894 1/20 0.40
TGFBR1 P36897 1/20 0.40
ACVRL1 P37023 1/20 0.40
ACVR1 Q04771 1/20 0.40
PARP1 P09874 1/20 0.40
FGFR2 P21802 1/20 0.40
FGFR3 P22607 1/20 0.40
SIGMAR1 Q99720 2/20 0.39
JAK2 O60674 1/20 0.39
AURKA O14965 1/20 0.39
AURKB Q96GD4 1/20 0.39
MAP2K1 Q02750 1/20 0.39
CHEK1 O14757 1/20 0.38
CYP2D6 P10635 1/20 0.37

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
SCHEMBL2865177 0.89 FGFR1 (0.45) FGFR1KDRPDGFRBKDM4EMAOA
SCHEMBL2861337 0.89 KDM4E (0.50) FGFR1KDRPDGFRBKDM4EMAOA
SCHEMBL2857971 0.88 FGFR1 (0.48) FGFR1KDRPDGFRBKDM4EMAOA
SCHEMBL2867604 0.86 FGFR1 (0.43) FGFR1KDRPDGFRBKDM4EMAOA
SCHEMBL2866809 0.85 MCHR1 (0.51) FGFR1KDRPDGFRBKDM4EEPHX2
SCHEMBL2861085 0.84 MAOA (0.42) FGFR1KDRPDGFRBKDM4EMAOA
SCHEMBL2864303 0.81 FGFR1 (0.48) FGFR1KDRPDGFRBKDM4EPARP1
SCHEMBL2865355 0.81 FGFR1 (0.43) FGFR1KDRPDGFRBKDM4EMAOA
SCHEMBL2870417 0.80 PDGFRB (0.43) FGFR1KDRPDGFRBKDM4EMAOA
SCHEMBL2868581 0.80 KDM4E (0.49) FGFR1KDRPDGFRBKDM4EMAOA

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 201/4885KDR 1226/4885PDGFRB 375/4885

“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.