SCHEMBL2944788

SCHEMBL2944788

COC(=O)[C@H]1CC[C@H](N2COCCC2=O)CC1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
BRD4 O60885 1/20 0.39
TP53 P04637 1/20 0.36
BTK Q06187 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
ALDH1A1 P00352 2/20 0.33
HSP90AA1 P07900 1/20 0.33

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
SCHEMBL2944792 1.00 KMT2A (0.39) KMT2ANPC1RAB9ABRD4TP53
SCHEMBL2944275 0.85 BRD4 (0.41) KMT2ANPC1RAB9ABRD4TP53
SCHEMBL2944277 0.85 BRD4 (0.41) KMT2ANPC1RAB9ABRD4TP53
SCHEMBL2951812 0.82 POLB (0.41) KMT2ANPC1RAB9A
SCHEMBL2951809 0.82 POLB (0.41) KMT2ANPC1RAB9A
SCHEMBL2943702 0.78 NPY5R (0.46) KMT2ANPC1RAB9ABRD4TP53
SCHEMBL2599858 0.78 NPY5R (0.46) KMT2ANPC1RAB9ABRD4TP53
SCHEMBL2945600 0.77 BRD4 (0.39) KMT2ABRD4TP53BTKSMN1; SMN2
SCHEMBL2945601 0.77 BRD4 (0.39) KMT2ABRD4TP53BTKSMN1; SMN2
SCHEMBL13780076 0.77 PKM (0.38) KMT2ATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7737161-B2 Condensed furan compounds MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-06-15 US disclosed
US-20090156803-A1 Condensed furan compounds KAWAGUCHI TAKAYUKI 2009-06-18 US disclosed
US-7514449-B2 Fused furan compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-04-07 US disclosed
US-20060094724-A1 Fused furan compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2006-05-04 US disclosed
EP-1582521-A1 FUSED FURAN COMPOUND TANABE SEIYAKU CO., LTD. (JP) 2005-10-05 EP 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-20090156803-A1 Condensed furan compounds F2, F12, F11 KMT2A 2033/4885NPC1 4426/4885RAB9A 4692/4885
US-20060094724-A1 Fused furan compound F2, F12, F11 KMT2A 1957/4885NPC1 4566/4885RAB9A 4494/4885

“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.