SCHEMBL7314423

SCHEMBL7314423

NCCc1cn(CC(=O)N2CCCC2C(=O)O)c2ccc(OCc3ccccc3)cc12

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 5/20 0.49
LTB4R2 Q9NPC1 4/20 0.49
EGFR P00533 2/20 0.46
IGF1R P08069 2/20 0.46
FLT4 P35916 2/20 0.46
KDR P35968 2/20 0.46
SPHK1 Q9NYA1 2/20 0.46
SPHK2 Q9NRA0 1/20 0.46
ACE P12821 2/20 0.45
CFD P00746 2/20 0.44
AKR1A1 P14550 1/20 0.43
AKR1B1 P15121 1/20 0.43
GYS1 P13807 2/20 0.42
F2 P00734 1/20 0.42
PRSS1 P07477 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
SCHEMBL7314411 1.00 LTB4R (0.49) LTB4RLTB4R2EGFRIGF1RFLT4
SCHEMBL7320930 0.90 PDCD1 (0.46) GYS1
SCHEMBL7309258 0.85 CFD (0.42) EGFRIGF1RFLT4KDRCFD
SCHEMBL7309274 0.85 CFD (0.42) EGFRIGF1RFLT4KDRCFD
SCHEMBL7310606 0.82 GYS1 (0.39) LTB4RLTB4R2EGFRIGF1RFLT4
SCHEMBL7314504 0.73 LTB4R (0.53) LTB4RLTB4R2EGFRIGF1RFLT4
SCHEMBL19234110 0.73 CFD (0.80) CFD
SCHEMBL7310670 0.72 LTB4R (0.53) LTB4RLTB4R2EGFRIGF1RFLT4
SCHEMBL7318362 0.72 EGFR (0.54) LTB4RLTB4R2EGFRIGF1RFLT4
SCHEMBL7310577 0.72 LTB4R (0.52) LTB4RLTB4R2EGFRIGF1RFLT4

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 LTB4R 1512/4885LTB4R2 1564/4885EGFR 4683/4885

“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.