SCHEMBL2866823

SCHEMBL2866823

COC(=O)c1cccc(-n2nc3c(c2N)c(=O)[nH]c2ccccc23)c1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.46
ALDH1A1 P00352 2/20 0.46
KMT2A Q03164 2/20 0.46
HPGD P15428 2/20 0.46
KDM4E B2RXH2 1/20 0.46
HSD17B10 Q99714 1/20 0.46
PARP1 P09874 1/20 0.45
KIF11 P52732 1/20 0.45
PMM2 O15305 1/20 0.43
MPI P34949 1/20 0.43
RAB9A P51151 1/20 0.43
PHOSPHO1 Q8TCT1 1/20 0.43
TP53 P04637 1/20 0.42
ADORA3 P0DMS8 2/20 0.42
ADORA1 P30542 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ESRRA P11474 1/20 0.41
TDP2 O95551 1/20 0.41

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
SCHEMBL2865387 0.88 TDP2 (0.46) MEN1KMT2AKDM4EPARP1PMM2
SCHEMBL2862967 0.84 ADORA3 (0.58) MEN1ALDH1A1KMT2AKDM4EHSD17B10
SCHEMBL13025364 0.83 ADORA3 (0.46) MEN1ALDH1A1KMT2AHPGDKDM4E
SCHEMBL2878474 0.82 TDP2 (0.49) MEN1KMT2AKDM4ERAB9AADORA3
SCHEMBL2859052 0.82 TDP2 (0.45) PARP1ADORA3ADORA1TDP2
SCHEMBL2865572 0.81 ADORA3 (0.43) MEN1ALDH1A1KMT2AHPGDKDM4E
SCHEMBL2861092 0.80 ADORA3 (0.53) MEN1KMT2AKDM4EHSD17B10PARP1
SCHEMBL2868721 0.80 ADORA3 (0.45) ADORA3ADORA1TDP2
SCHEMBL2864776 0.80 TDP2 (0.45) TP53ADORA3ADORA1TDP2
SCHEMBL2863178 0.80 ADORA3 (0.57) RAB9ATP53ADORA3ADORA1TDP2

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 MEN1 3903/4885ALDH1A1 2391/4885KMT2A 1037/4885

“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.