SCHEMBL7529247

SCHEMBL7529247

O=C(O)CN1CCN(CC2CC(c3ccc(C=NNCc4ccncc4)cc3)NO2)CC1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 1/20 0.37
▸ POLB P06746 4/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ L3MBTL1 Q9Y468 3/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ MAPK11 Q15759 1/20 0.32
▸ MAPK14 Q16539 1/20 0.32
▸ ACHE P22303 2/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ RAB9A P51151 1/20 0.31

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
SCHEMBL7525406 0.91 HTT (0.36) THRBPOLBL3MBTL1ACHEALDH1A1
SCHEMBL7529760 0.86 POLB (0.34) POLBL3MBTL1MEN1KMT2AACHE
SCHEMBL7528865 0.84 POLB (0.34) POLBSMN1; SMN2L3MBTL1ACHEALDH1A1
SCHEMBL7533134 0.84 ACHE (0.37) POLBSMN1; SMN2L3MBTL1MEN1KMT2A
SCHEMBL7528715 0.83 SMN1; SMN2 (0.33) POLBSMN1; SMN2L3MBTL1MEN1KMT2A
SCHEMBL7532573 0.83 POLB (0.33) POLBSMN1; SMN2L3MBTL1KMT2AACHE
SCHEMBL7528229 0.83 ALDH1A1 (0.34) THRBPOLBSMN1; SMN2L3MBTL1ACHE
SCHEMBL7531082 0.83 SMN1; SMN2 (0.41) POLBSMN1; SMN2L3MBTL1MEN1KMT2A
SCHEMBL7531880 0.82 POLB (0.36) POLBSMN1; SMN2L3MBTL1KMT2AACHE
SCHEMBL7527817 0.82 ACHE (0.35) POLBSMN1; SMN2L3MBTL1MEN1KMT2A

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-6476226-B2 PLATELET GLYCOPROTEIN IIB/IIIA FIBRINOGEN; ANTICOAGULANTS; THROMBOLYTIC AGENTS; THROMBOEMBOLIC DISORDERS; ANTIINFLAMMATORY AGENTS; BONE DISORDERS; ANTITUMOR, -METASTASIS, -ARTHRITIC AGENTS; ASTHMA; PSORIASIS BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-11-05 — — US disclosed
US-20020094978-A1 Novel isoxazoline fibrinogen receptor antagonists BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-07-18 — — 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-20020094978-A1 Novel isoxazoline fibrinogen receptor antagonists F13B, F11, FGB THRB 1106/4885POLB 3542/4885SMN1; SMN2 4508/4885

“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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