SCHEMBL6109802

SCHEMBL6109802

CC(C)(C)c1ccc(C(=O)Nc2ccc(C(=O)Nc3ccc(Cl)cn3)cc2C(=O)O)cc1

nearest known ligand 0.71

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 1/20 0.71
DEGS1 O15121 1/20 0.58
F10 P00742 16/20 0.58
KCNH2 Q12809 2/20 0.58
KLKB1 P03952 3/20 0.57
TP53 P04637 1/20 0.56
TSHR P16473 1/20 0.56
NFKB1 P19838 1/20 0.56
RAB9A P51151 1/20 0.56
NFKB2 Q00653 1/20 0.56
RELA Q04206 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56

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
SCHEMBL6109799 0.93 PPARG (0.63) SERPINE1F10KCNH2KLKB1
SCHEMBL6107398 0.86 KCNH2 (0.62) F10KCNH2KLKB1
SCHEMBL6108304 0.84 F10 (0.72) F10
SCHEMBL420142 0.84 SERPINE1 (1.00) SERPINE1
SCHEMBL6773804 0.83 F10 (0.65) DEGS1F10KCNH2KLKB1TP53
SCHEMBL6107226 0.80 F10 (0.60) DEGS1F10KCNH2KLKB1TP53
SCHEMBL6109346 0.80 SERPINE1 (0.77) SERPINE1
SCHEMBL6107388 0.79 F10 (0.64) F10KCNH2TP53TSHRNFKB1
SCHEMBL5642612 0.79 F10 (0.70) F10KCNH2KLKB1
SCHEMBL3650071 0.79 F10 (0.67) F10KCNH2KLKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7129245-B2 Anticoagulants which act selectively on factor Xa; fast acting; oral; do not interfere with lysis of blood clots ELI LILLY AND COMPANY (US) 2006-10-31 US disclosed
US-20050282862-A1 Aromatic amides BEIGHT DOUGLAS W 2005-12-22 US disclosed
EP-1140903-B1 AROMATIC AMIDES LILLY CO ELI (US) 2004-08-04 EP disclosed
US-6759414-B2 ANTICOAGULANTS WHICH ACT SELECTIVELY ON FACTOR XA; FAST ACTING; ORAL; DO NOT INTERFERE WITH LYSIS OF BLOOD CLOTS ELI LILLY AND COMPANY 2004-07-06 US disclosed
US-20040029874-A1 Aromatic amides BEIGHT DOUGLAS WADE (US) 2004-02-12 US disclosed
US-6635657-B1 Pyridine derivatives; anticoagulants ELI LILLY AND COMPANY 2003-10-21 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 (2 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-20040029874-A1 Aromatic amides F11, F12, F5 SERPINE1 71/4885DEGS1 1113/4885F10 12/4885
US-20050282862-A1 Aromatic amides F11, F12, F5 SERPINE1 71/4885DEGS1 1113/4885F10 12/4885

“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.