SCHEMBL6796739

SCHEMBL6796739

O=C(O)c1ccccc1C(=O)Nc1cccc(-c2cccc(-n3c(=O)c(Cc4cccnc4)nc4cccnc43)c2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.47
BCR P11274 1/20 0.47
SRC P12931 1/20 0.47
EGFR P00533 1/20 0.43
BTK Q06187 1/20 0.43
ITK Q08881 1/20 0.43
KDR P35968 1/20 0.42
AKT1 P31749 1/20 0.41
CYP2C9 P11712 2/20 0.40
HMOX1 P09601 1/20 0.40
HMOX2 P30519 1/20 0.40
MAPT P10636 4/20 0.40
USP2 O75604 1/20 0.39
KDM4E B2RXH2 2/20 0.39
POLB P06746 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
LRRK2 Q5S007 2/20 0.38
MAPK1 P28482 2/20 0.38
SGMS2 Q8NHU3 1/20 0.38
KMT2A Q03164 2/20 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
Hydrochloric Acid SCHEMBL6791483 0.91 AKT1 (0.46) ABL1BCRSRCEGFRBTK
SCHEMBL6798942 0.90 EGFR (0.46) EGFRBTKITKAKT1CYP2C9
SCHEMBL6796159 0.88 RAB9A (0.49) ABL1BCRSRCEGFRBTK
SCHEMBL6801778 0.87 EGFR (0.45) EGFRBTKITKAKT1CYP2C9
SCHEMBL6794158 0.87 SIRT2 (0.47) ABL1BCREGFRBTKITK
SCHEMBL6798067 0.87 CYP11B2 (0.47) EGFRBTKITKKDRHMOX1
SCHEMBL6801892 0.86 EGFR (0.44) EGFRBTKITKAKT1MAPT
SCHEMBL6799786 0.86 EGFR (0.49) ABL1BCRSRCEGFRBTK
SCHEMBL6795912 0.86 EGFR (0.43) EGFRBTKITKAKT1MAPT
SCHEMBL6804831 0.86 NPC1 (0.44) EGFRBTKITKMAPTUSP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6727245-B2 4-(HETERO)ARYL-3-OXO-3,4-DIHYDROPYRIDO(2,3-B)PYRAZINE DERIVATIVES; PROPHYLACTIC OR THERAPEUTIC TREATMENT OF PHOSPHODIESTERASE IV AND TUMOR NECROSIS FACTOR MEDIATED DISEASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-04-27 US disclosed
EP-0770079-B1 HETEROBICYCLIC DERIVATIVES FUJISAWA PHARMACEUTICAL CO (JP) 2003-02-12 EP disclosed
US-20020107251-A1 Heterobicyclic derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-08-08 US disclosed
US-6426345-B1 PHOSPHODIESTERASE INHIBITORS; ANTIINFLAMMATORY AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-07-30 US disclosed
EP-0920867-A1 Pyrido[2,3-a]pyrazine derivatives as PDE-IV and TNF inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-06-09 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-20020107251-A1 Heterobicyclic derivatives ARSA, ARRB1, SULT2A1 ABL1 408/4885BCR 1628/4885SRC 232/4885

“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.