SCHEMBL7320717

SCHEMBL7320717

N#Cc1cccc(Cn2cc(CCN)c3cc(OCc4ccc(C(=O)O)cc4)ccc32)c1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EGFR P00533 4/20 0.50
IGF1R P08069 4/20 0.50
FLT4 P35916 4/20 0.50
KDR P35968 4/20 0.50
PPARD Q03181 3/20 0.49
PPARG P37231 2/20 0.49
PPARA Q07869 2/20 0.49
FFAR1 O14842 1/20 0.47
FFAR4 Q5NUL3 1/20 0.47
ALKBH1 Q13686 1/20 0.47
CYSLTR2 Q9NS75 1/20 0.46
CYSLTR1 Q9Y271 1/20 0.46
LTB4R Q15722 3/20 0.45
LTB4R2 Q9NPC1 3/20 0.45
PLA2G2A P14555 1/20 0.43
GPR34 Q9UPC5 1/20 0.42

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
SCHEMBL7318738 0.93 ALKBH1 (0.49) EGFRIGF1RFLT4KDRPPARD
SCHEMBL7310034 0.89 EGFR (0.54) EGFRIGF1RFLT4KDRPPARD
SCHEMBL7307437 0.88 ALKBH1 (0.49) EGFRIGF1RFLT4KDRPPARD
SCHEMBL7319275 0.88 EGFR (0.49) EGFRIGF1RFLT4KDRPPARD
Trifluoroacetic Acid SCHEMBL7308661 0.87 EGFR (0.47) EGFRIGF1RFLT4KDRPPARD
SCHEMBL7580527 0.86 LTB4R (0.49) EGFRIGF1RFLT4KDRPPARD
SCHEMBL7319193 0.86 FFAR1 (0.47) EGFRIGF1RFLT4KDRPPARD
SCHEMBL7318188 0.86 EGFR (0.57) EGFRIGF1RFLT4KDRPPARD
SCHEMBL7316830 0.85 EGFR (0.52) EGFRIGF1RFLT4KDRPPARD
SCHEMBL7318677 0.85 EGFR (0.55) EGFRIGF1RFLT4KDRPPARD

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-20010007877-A1 NOVEL ANTI-INFECTIVES SMITHKLINE BEECHAM CORPORATION 2001-07-12 US claimed
WO-2001034146-A1 NOVEL ANTI-INFECTIVES SMITHKLINE BEECHAM CORPORATION (US) 2001-05-17 WO claimed
US-20010007877-A1 NOVEL ANTI-INFECTIVES SMITHKLINE BEECHAM CORPORATION 2001-07-12 US 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-20010007877-A1 NOVEL ANTI-INFECTIVES CTSL, MMP8, SERPINB1 EGFR 4683/4885IGF1R 4834/4885FLT4 4417/4885

“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.