SCHEMBL2946264

SCHEMBL2946264

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

nearest known ligand 0.78

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.78
ALDH1A1 P00352 4/20 0.58
TSHR P16473 3/20 0.58
HTT P42858 1/20 0.55
CHRNB2 P17787 1/20 0.54
CHRNA3 P32297 1/20 0.54
CHRNA4 P43681 1/20 0.54
CHRNB3 Q05901 1/20 0.54
CHRNA6 Q15825 1/20 0.54
SMN1; SMN2 Q16637 3/20 0.50
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
LMNA P02545 1/20 0.48
NPC1 O15118 1/20 0.46
TP53 P04637 1/20 0.46
TFPI2 P48307 1/20 0.44
HSD11B1 P28845 1/20 0.44

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
SCHEMBL2946268 1.00 HPGD (0.78) HPGDALDH1A1TSHRHTTCHRNB2
SCHEMBL700845 0.98 HPGD (0.83) HPGDALDH1A1TSHRHTTCHRNB2
SCHEMBL700843 0.98 HPGD (0.83) HPGDALDH1A1TSHRHTTCHRNB2
SCHEMBL806748 0.91 HPGD (0.95) HPGDALDH1A1TSHRHTTCHRNB2
SCHEMBL19658219 0.91 HPGD (0.95) HPGDALDH1A1TSHRHTTCHRNB2
SCHEMBL3282290 0.88 HPGD (0.60) HPGDALDH1A1TSHRHTTCHRNB2
SCHEMBL19612780 0.88 HPGD (1.00) HPGDALDH1A1TSHRHTTCHRNB2
SCHEMBL3504308 0.88 HPGD (1.00) HPGDALDH1A1TSHRHTTCHRNB2
SCHEMBL16992039 0.88 HPGD (1.00) HPGDALDH1A1TSHRHTTCHRNB2
SCHEMBL20186941 0.88 HPGD (1.00) HPGDALDH1A1TSHRHTTCHRNB2

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 20 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-7737161-B2 Condensed furan compounds MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-06-15 US disclosed
US-7737161-B2 Condensed furan compounds MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-06-15 US disclosed
US-7605158-B2 Carbamoyl-type benzofuran derivatives MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-10-20 US disclosed
US-7605158-B2 Carbamoyl-type benzofuran derivatives MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-10-20 US disclosed
US-20090156803-A1 Condensed furan compounds KAWAGUCHI TAKAYUKI 2009-06-18 US disclosed
US-20090156803-A1 Condensed furan compounds KAWAGUCHI TAKAYUKI 2009-06-18 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-7514449-B2 Fused furan compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-04-07 US 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
US-7375119-B2 Amide type carboxamide derivative MITSUBISHI TANABE PHARMA CORPORATION (JP) 2008-05-20 US disclosed
US-7375119-B2 Amide type carboxamide derivative MITSUBISHI TANABE PHARMA CORPORATION (JP) 2008-05-20 US disclosed
US-20060287329-A1 Amide type carboxamide derivative MITSUBISHI TANABE PHARMA CORPORATION (JP) 2006-12-21 US disclosed
US-20060247273-A1 Carbamoyl-type benzofuran derivatives MITSUBISHI TANABE PHARMA CORPORATION (JP) 2006-11-02 US disclosed
EP-1666455-A1 AMIDE TYPE CARBOXAMIDE DERIVATIVE TANABE SEIYAKU CO., LTD. (JP) 2006-06-07 EP disclosed
EP-1666478-A1 CARBAMOYL-TYPE BENZOFURAN DERIVATIVES 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
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 (4 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-20060287329-A1 Amide type carboxamide derivative F12, F11, F13A1 HPGD 3301/4885ALDH1A1 884/4885TSHR 490/4885
US-20060247273-A1 Carbamoyl-type benzofuran derivatives F12, F2, F3 HPGD 1853/4885ALDH1A1 1153/4885TSHR 1235/4885
US-20090156803-A1 Condensed furan compounds F2, F12, F11 HPGD 431/4885ALDH1A1 1627/4885TSHR 3368/4885
US-20060094724-A1 Fused furan compound F2, F12, F11 HPGD 600/4885ALDH1A1 1674/4885TSHR 3045/4885

“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.