SCHEMBL7525075

SCHEMBL7525075

O=C(O)CN1CCN(CC2CC(c3ccc(C=NNCc4ccccc4)cc3)=NO2)CC1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.40
MIF P14174 4/20 0.39
POLB P06746 1/20 0.39
L3MBTL1 Q9Y468 3/20 0.38
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
TSHR P16473 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ACHE P22303 2/20 0.38
ALDH1A1 P00352 1/20 0.38
HDAC6 Q9UBN7 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
SCHEMBL7525051 1.00 ATM (0.40) ATMMIFPOLBL3MBTL1MEN1
SCHEMBL7529256 0.93 MIF (0.38) ATMMIFPOLBL3MBTL1HDAC6
SCHEMBL7525415 0.92 POLB (0.41) MIFPOLBMEN1KMT2A
SCHEMBL7533142 0.91 MIF (0.38) MIFL3MBTL1LMNAACHEALDH1A1
SCHEMBL7527826 0.89 MIF (0.36) MIFL3MBTL1LMNAACHEALDH1A1
SCHEMBL7529774 0.89 NPC1 (0.43) MIFPOLBLMNAKMT2AALDH1A1
SCHEMBL7378339 0.89 MIF (0.41) ATMMIFL3MBTL1MEN1LMNA
SCHEMBL7525924 0.89 ACHE (0.42) ATMMIFPOLBL3MBTL1MEN1
SCHEMBL7531875 0.88 MIF (0.38) MIFPOLBMEN1LMNAKMT2A
SCHEMBL7531887 0.88 MIF (0.38) MIFPOLBMEN1LMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020094978-A1 Novel isoxazoline fibrinogen receptor antagonists BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-07-18 US claimed
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
US-6303609-B1 USED FOR THE INHIBITION OF PLATELET AGGREGATION, AS THROMBOLYTICS, AND/OR FOR THE TREATMENT OF THROMBOEMBOLIC DISORDERS DUPONT PHARMACEUTICALS COMPANY 2001-10-16 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 ATM 3203/4885MIF 1918/4885POLB 3542/4885

“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.