SCHEMBL6948403

SCHEMBL6948403

COC(=O)c1cc(C(=O)Nc2cccc(-n3c(=O)c(Cc4cccnc4)nc4cccnc43)c2)cc(C(=O)OC)c1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EGFR P00533 3/20 0.48
BTK Q06187 3/20 0.48
ITK Q08881 2/20 0.48
LMNA P02545 1/20 0.42
STAT3 P40763 1/20 0.42
GAA P10253 2/20 0.41
TP53 P04637 3/20 0.41
RAB9A P51151 1/20 0.40
POLB P06746 2/20 0.39
TSHR P16473 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HSD17B13 Q7Z5P4 1/20 0.38
RXFP1 Q9HBX9 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
Hydrochloric Acid SCHEMBL6795949 0.99 EGFR (0.47) EGFRBTKITKLMNASTAT3
SCHEMBL6797252 0.94 EGFR (0.43) EGFRBTKITKLMNASTAT3
SCHEMBL6798452 0.93 EGFR (0.48) EGFRBTKITKLMNASTAT3
SCHEMBL6803778 0.91 EGFR (0.52) EGFRBTKITKGAARAB9A
SCHEMBL6796375 0.90 EGFR (0.46) EGFRBTKITKGAATP53
SCHEMBL6799786 0.89 EGFR (0.49) EGFRBTKITKTP53RAB9A
SCHEMBL6793314 0.89 TSHR (0.54) EGFRBTKITKLMNAGAA
SCHEMBL6954213 0.89 EGFR (0.44) EGFRBTKITKGAATP53
SCHEMBL6796219 0.89 EGFR (0.44) EGFRBTKITKTP53POLB
SCHEMBL6793480 0.89 EGFR (0.44) EGFRBTKITKLMNAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0770079-B1 HETEROBICYCLIC DERIVATIVES FUJISAWA PHARMACEUTICAL CO (JP) 2003-02-12 EP claimed
US-20020107251-A1 Heterobicyclic derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-08-08 US claimed
US-6426345-B1 PHOSPHODIESTERASE INHIBITORS; ANTIINFLAMMATORY AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-07-30 US claimed
EP-0920867-A1 Pyrido[2,3-a]pyrazine derivatives as PDE-IV and TNF inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-06-09 EP claimed
EP-0770079-A1 HETEROBICYCLIC DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-05-02 EP claimed
WO-1996001825-A1 HETEROBICYCLIC DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-01-25 WO claimed
EP-0805796-A1 CELL ADHESION INHIBITORS BIOGEN, INC. (US) 1997-11-12 EP disclosed
WO-1996022966-A1 CELL ADHESION INHIBITORS BIOGEN, INC. (US) 1996-08-01 WO 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 EGFR 419/4885BTK 2100/4885ITK 4538/4885

“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.