SCHEMBL16782297

SCHEMBL16782297

COC(=O)Nc1ccc2c(c1)NC(=O)C(C)CCCC(N1CCC(c3c(F)ccc(Cl)c3F)=CC1=O)c1cc-2ccn1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ F11 P03951 18/20 1.00
▸ F12 P00748 1/20 1.00
▸ PLAT P00750 1/20 1.00
▸ PROC P04070 1/20 1.00
▸ F7 P08709 1/20 1.00
▸ CTRB1 P17538 1/20 1.00
▸ CTRL P40313 1/20 1.00
▸ CTRB2 Q6GPI1 1/20 1.00
▸ CTRC Q99895 1/20 1.00
▸ KLKB1 P03952 19/20 0.90
▸ F9 P00740 15/20 0.89

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
SCHEMBL15597198 1.00 F11 (1.00) F11F12PLATPROCF7
SCHEMBL15456517 1.00 F11 (1.00) F11F12PLATPROCF7
SCHEMBL15597251 1.00 F11 (1.00) F11F12PLATPROCF7
SCHEMBL15456413 1.00 F11 (1.00) F11F12PLATPROCF7
SCHEMBL18536117 0.94 KLKB1 (1.00) F11F12PLATPROCF7
SCHEMBL15594051 0.94 KLKB1 (1.00) F11F12PLATPROCF7
SCHEMBL15594137 0.94 F11 (1.00) F11F12PLATPROCF7
SCHEMBL17991856 0.94 KLKB1 (1.00) F11F12PLATPROCF7
SCHEMBL16910511 0.94 F11 (0.91) F11F12PLATPROCF7
SCHEMBL18124051 0.94 F11 (0.91) F11F12PLATPROCF7

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
EP-2882734-B1 DIHYDROPYRIDONE AS FACTOR XIA INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2016-10-12 — — EP disclosed
US-9376444-B2 Dihydropyridone P1 as factor XIa inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2016-06-28 — — US disclosed
US-20150166550-A1 DIHYDROPYRIDONE P1 AS FACTOR XIA INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2015-06-18 — — 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-20150166550-A1 DIHYDROPYRIDONE P1 AS FACTOR XIA INHIBITORS TFPI, TFPI2, F11 F11 3/4885F12 4/4885PLAT 33/4885

“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.

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