SCHEMBL5640096

SCHEMBL5640096

O=C(NCC1CC(=O)N(c2ccc(-n3ccccc3=O)cc2)C1)c1nc2cc(Cl)ccc2s1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ F10 P00742 15/20 0.43
▸ CNR1 P21554 1/20 0.43
▸ PAK1 Q13153 1/20 0.40
▸ LMNA P02545 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ MAOB P27338 1/20 0.37

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
SCHEMBL5640928 0.93 MAPT (0.43) MAPTMEN1KMT2AF10CNR1
SCHEMBL5643192 0.90 CNR1 (0.54) MAPTMEN1KMT2ACNR1PAK1
SCHEMBL5640620 0.85 F10 (0.58) MAPTMEN1KMT2AF10LMNA
SCHEMBL5643218 0.84 F10 (0.44) MAPTMEN1KMT2AF10CNR1
SCHEMBL5638208 0.83 F10 (0.58) MAPTMEN1KMT2AF10LMNA
SCHEMBL5639265 0.83 F10 (0.44) MAPTMEN1KMT2AF10
SCHEMBL5639021 0.81 F10 (0.58) F10
SCHEMBL4594684 0.81 F10 (0.55) F10LMNATP53
SCHEMBL5641757 0.80 F10 (0.55) F10
SCHEMBL5640312 0.80 CNR1 (0.38) MAPTMEN1KMT2AF10CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7199149-B2 Monocyclic and bicyclic lactams as factor Xa inhibitors BRISTOL MYERS SQUIBB COMPANY (US) 2007-04-03 — — US disclosed
US-20050107361-A1 Monocyclic and bicyclic lactams as factor Xa inhibitors BRISTOL-MYERS SQUIBB COMANY 2005-05-19 — — 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-20050107361-A1 Monocyclic and bicyclic lactams as factor Xa inhibitors F2, F12, SPINT2 MAPT 4614/4885MEN1 671/4885KMT2A 3394/4885

“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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