SCHEMBL961476

SCHEMBL961476

COc1cccc(OCCCc2oc(-n3ccnc3C)nc2-c2ccc(Cl)cc2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
NPSR1 Q6W5P4 1/20 0.38
ICMT O60725 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
MCL1 Q07820 1/20 0.36
GRM5 P41594 1/20 0.35
HSD17B10 Q99714 3/20 0.35
LMNA P02545 3/20 0.35
USP2 O75604 2/20 0.35
ALDH1A1 P00352 2/20 0.35
CYP1A2 P05177 2/20 0.35
CYP3A4 P08684 2/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2C19 P33261 2/20 0.35
TSHR P16473 2/20 0.35
MAPK1 P28482 2/20 0.35
CASP1 P29466 1/20 0.35
CASP7 P55210 1/20 0.35

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
SCHEMBL1361648 0.92 GRM5 (0.40) NPSR1ICMTTDP1L3MBTL1GRM5
SCHEMBL1360001 0.91 CYP1A2 (0.41) TDP1L3MBTL1LMNAUSP2ALDH1A1
SCHEMBL1362394 0.90 TDP1 (0.47) RXFP1ICMTTDP1L3MBTL1LMNA
SCHEMBL1361791 0.88 ICMT (0.49) ICMTTDP1L3MBTL1CYP1A2CYP3A4
SCHEMBL1360080 0.87 GRM5 (0.41) ICMTTDP1L3MBTL1GRM5LMNA
SCHEMBL1362039 0.86 TUBB4A (0.39) ICMTTDP1L3MBTL1GRM5LMNA
SCHEMBL1362578 0.86 TDP1 (0.44) TDP1L3MBTL1CYP1A2CYP3A4CYP2C9
SCHEMBL1363090 0.86 SMN1; SMN2 (0.36) ICMTLMNAUSP2ALDH1A1CYP1A2
SCHEMBL1362240 0.86 CYP1A2 (0.36) ICMTTDP1L3MBTL1MCL1GRM5
SCHEMBL1360093 0.86 CYP1A2 (0.42) RXFP1TDP1L3MBTL1GRM5CYP1A2

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-20080269219-A1 Neurotrophin production/secretion promoting agent TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-10-30 US claimed
US-7396848-B1 oxazole derivatives to treat diabetic neuropathy and/or other kinds of peripheral neuropathy; 4-(4-chlorophenyl)-5-[3-(2-methoxyphenoxy)propyl]-2-(2-methyl-1-imidazolyl)oxazole TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-07-08 US claimed
EP-1206472-B1 OXAZOLE AND THIAZOLE DERIVATIVES AS NEUROTROPHIN PRODUCTION/SECRETION PROMOTING AGENT TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-10-01 EP claimed
EP-1206472-A1 OXAZOLE AND THIAZOLE DERIVATIVES AS NEUROTROPHIN PRODUCTION/SECRETION PROMOTING AGENT Takeda Chemical Industries, Ltd. (JP) 2002-05-22 EP claimed
WO-2001014372-A2 OXAZOLE AND THIAZOLE DERIVATIVES AS NEUROTROPHIN PRODUCTION/SECRETION PROMOTING AGENT TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-03-01 WO claimed
EP-1491194-B1 VDAC REGULATOR TAKEDA PHARMACEUTICAL (JP) 2013-10-30 EP disclosed
US-8067453-B2 Oxazole compound to treat or prevent diabetic neuropathy; 4-(4-chlorophenyl)-5-(3-(2-methoxyphenoxy)propyl-2-methyl-1-imidazolyl)oxazole TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-11-29 US disclosed
US-20110009384-A1 FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA TAKEDA PHARMACEUTICAL COMPANY LIMITED 2011-01-13 US disclosed
US-7498352-B2 TGF-β superfamily production/secretion promoter TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-03-03 US disclosed
US-7462635-B2 Thiazole and oxazole VDAC regulator TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-12-09 US disclosed
US-20080269219-A1 Neurotrophin production/secretion promoting agent TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-10-30 US disclosed
US-20080194617-A1 Fused ring compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-08-14 US disclosed
US-7396848-B1 oxazole derivatives to treat diabetic neuropathy and/or other kinds of peripheral neuropathy; 4-(4-chlorophenyl)-5-[3-(2-methoxyphenoxy)propyl]-2-(2-methyl-1-imidazolyl)oxazole TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-07-08 US disclosed
US-20050234116-A1 Vdac regulator TAKEDA CHEMICAL INDUSTRIES, LTD. 2005-10-20 US disclosed
US-20040142988-A1 Tgf-beta superfamily production/secretion promoter TAKEDA PHARMACETUTICAL COMPANY LIMITED (JP) 2004-07-22 US disclosed
EP-1407770-A1 TGF-BETA SUPERFAMILY PRODUCTION/SECRETION PROMOTER Takeda Chemical Industries, Ltd. (JP) 2004-04-14 EP disclosed
EP-1206472-B1 OXAZOLE AND THIAZOLE DERIVATIVES AS NEUROTROPHIN PRODUCTION/SECRETION PROMOTING AGENT TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-10-01 EP disclosed
US-6605629-B1 Oxazole derivatives; low toxicity TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2003-08-12 US disclosed
EP-1206472-A1 OXAZOLE AND THIAZOLE DERIVATIVES AS NEUROTROPHIN PRODUCTION/SECRETION PROMOTING AGENT Takeda Chemical Industries, Ltd. (JP) 2002-05-22 EP disclosed
WO-2001014372-A2 OXAZOLE AND THIAZOLE DERIVATIVES AS NEUROTROPHIN PRODUCTION/SECRETION PROMOTING AGENT TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-03-01 WO 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-20080194617-A1 Fused ring compound SLC5A1, SLC5A2, GPR119 POLB 3524/4885RXFP1 1351/4885NPSR1 2214/4885
US-20080269219-A1 Neurotrophin production/secretion promoting agent BDNF, NGF, NTRK2 POLB 4273/4885RXFP1 273/4885NPSR1 90/4885
US-20110009384-A1 FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA PPARA, PPARD, PPARG POLB 1580/4885RXFP1 207/4885NPSR1 814/4885
US-20040142988-A1 Tgf-beta superfamily production/secretion promoter TGFBR1, TGFBR2, SMAD2 POLB 1597/4885RXFP1 123/4885NPSR1 2677/4885
US-20050234116-A1 Vdac regulator VDAC1, VDAC2, VDAC3 POLB 3832/4885RXFP1 3082/4885NPSR1 3650/4885

“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.