SCHEMBL2943702

SCHEMBL2943702

COC(=O)[C@H]1CC[C@H](N2CCCC2=O)CC1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 4/20 0.46
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 1/20 0.44
MMP13 P45452 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
BRD4 O60885 1/20 0.41
TP53 P04637 1/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.40
ALDH1A1 P00352 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL2599858 1.00 NPY5R (0.46) NPY5RNPC1RAB9AKMT2AMMP13
SCHEMBL379487 0.84 ALDH1A1 (0.52) NPC1SMN1; SMN2ALDH1A1
SCHEMBL15877677 0.83 KMT2A (0.52) NPC1RAB9AKMT2ABRD4POLB
SCHEMBL15894492 0.83 KMT2A (0.52) NPC1RAB9AKMT2ABRD4POLB
SCHEMBL15877675 0.83 KMT2A (0.52) NPC1RAB9AKMT2ABRD4POLB
SCHEMBL12436637 0.82 NPY5R (0.45) NPY5RNPC1RAB9AKMT2AMMP13
SCHEMBL12513671 0.82 NPY5R (0.45) NPY5RNPC1RAB9AKMT2AMMP13
SCHEMBL2943960 0.80 POLB (0.47) NPY5RNPC1RAB9AKMT2AMMP13
SCHEMBL379809 0.80 POLB (0.47) NPY5RNPC1RAB9AKMT2AMMP13
SCHEMBL2136719 0.80 POLB (0.47) NPY5RNPC1RAB9AKMT2AMMP13

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 17 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
EP-1489078-B1 BENZOFURAN DERIVATIVE MITSUBISHI TANABE PHARMA CORP (JP) 2010-01-06 EP disclosed
US-20090209511-A1 Benzofuran Derivatives KAWAGUCHI TAKAYUKI 2009-08-20 US disclosed
US-20090156803-A1 Condensed furan compounds KAWAGUCHI TAKAYUKI 2009-06-18 US disclosed
US-7531537-B2 Benzofuran derivative MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-05-12 US disclosed
CN-100475777-C Amide type carboxamide derivative TANABE SEIYAKU CO (JP) 2009-04-08 CN disclosed
US-7514449-B2 Fused furan compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-04-07 US disclosed
US-7375119-B2 Amide type carboxamide derivative MITSUBISHI TANABE PHARMA CORPORATION (JP) 2008-05-20 US disclosed
CN-100344632-C Fused furan compound TANABE SEIYAKU CO (JP) 2007-10-24 CN disclosed
US-20060287329-A1 Amide type carboxamide derivative MITSUBISHI TANABE PHARMA CORPORATION (JP) 2006-12-21 US disclosed
CN-1860097-A Amide-type carboxamide derivative TANABE SEIYAKU CO (JP) 2006-11-08 CN disclosed
EP-1666455-A1 AMIDE TYPE CARBOXAMIDE DERIVATIVE TANABE SEIYAKU CO., LTD. (JP) 2006-06-07 EP disclosed
US-20060094724-A1 Fused furan compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2006-05-04 US disclosed
CN-1723210-A Fused furan compound TANABE SEIYAKU CO (JP) 2006-01-18 CN disclosed
US-20050282808-A1 Benzofuran derivative MITSUBISHI TANABE PHARMA CORPORATION (JP) 2005-12-22 US disclosed
EP-1582521-A1 FUSED FURAN COMPOUND TANABE SEIYAKU CO., LTD. (JP) 2005-10-05 EP disclosed
EP-1489078-A1 BENZOFURAN DERIVATIVE Tanabe Seiyaku Co., Ltd. (JP) 2004-12-22 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 (5 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-20050282808-A1 Benzofuran derivative F12, F2, F11 NPY5R 369/4885NPC1 3519/4885RAB9A 4616/4885
US-20060287329-A1 Amide type carboxamide derivative F12, F11, F13A1 NPY5R 42/4885NPC1 3642/4885RAB9A 2345/4885
US-20090156803-A1 Condensed furan compounds F2, F12, F11 NPY5R 805/4885NPC1 4426/4885RAB9A 4692/4885
US-20090209511-A1 Benzofuran Derivatives F12, F2, F3 NPY5R 375/4885NPC1 3431/4885RAB9A 4600/4885
US-20060094724-A1 Fused furan compound F2, F12, F11 NPY5R 589/4885NPC1 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.