SCHEMBL21639618

SCHEMBL21639618

CNc1cccc2cc(C(=O)Nc3cncnc3)c(=O)[nH]c12

nearest known ligand 0.72

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LCK P06239 2/20 0.41
KIT P10721 2/20 0.41
SRC P12931 2/20 0.41
MAPK14 Q16539 2/20 0.41
KDR P35968 2/20 0.41
BCAT2 O15382 1/20 0.41
RXFP1 Q9HBX9 1/20 0.40
DYRK1A Q13627 1/20 0.39
DYRK1B Q9Y463 1/20 0.39
ABL1 P00519 1/20 0.39
KDM4E B2RXH2 1/20 0.39
NPC1 O15118 1/20 0.39
MAPT P10636 1/20 0.39
TSHR P16473 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
BRD4 O60885 1/20 0.39
KCNH2 Q12809 1/20 0.38

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
SCHEMBL21639509 0.90 TSHR (0.52) KDM4ENPC1MAPTTSHRRAB9A
SCHEMBL23066443 0.87 NSD2 (0.50) DYRK1ADYRK1BNPC1RAB9ASMN1; SMN2
SCHEMBL21639635 0.87 DYRK1A (0.41) KDRDYRK1ADYRK1BKDM4ENPC1
SCHEMBL21639781 0.86 BRD4 (0.40) KDRRXFP1DYRK1ADYRK1BBRD4
SCHEMBL21639646 0.85 KCNH2 (0.50) KCNH2
SCHEMBL21639564 0.84 MAOA (0.50) KCNH2
SCHEMBL21639644 0.82 CA12 (0.48) NPC1MAPTRAB9ASMN1; SMN2KCNH2
SCHEMBL21674050 0.81 BRD4 (0.46) KDM4EBRD4
SCHEMBL21639501 0.80 RAB9A (0.51) DYRK1ADYRK1BABL1NPC1MAPT
SCHEMBL21639552 0.80 BRD4 (0.39) KDRBRD4KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210070747-A1 2(1H)-QUINOLINONE DERIVATIVE TAISHO PHARMACEUTICAL CO., LTD. (JP) 2021-03-11 US disclosed
US-20210070747-A1 2(1H)-QUINOLINONE DERIVATIVE TAISHO PHARMACEUTICAL CO., LTD. (JP) 2021-03-11 US disclosed
EP-3604281-A1 2(1H)-QUINOLINONE DERIVATIVE Taisho Pharmaceutical Co., Ltd. (JP) 2020-02-05 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-20210070747-A1 2(1H)-QUINOLINONE DERIVATIVE TOP2A, TOP2B, TOP1 LCK 4332/4885KIT 4051/4885SRC 4633/4885

“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.