SCHEMBL2353503

SCHEMBL2353503

CCOc1cccc(CO)c1OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
KDM4E B2RXH2 2/20 0.47
MAPT P10636 3/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
TSHR P16473 2/20 0.42
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
NPC1 O15118 2/20 0.41
ATM Q13315 2/20 0.41
AGTR1 P30556 1/20 0.41
ABCB1 P08183 2/20 0.41
ABCG2 Q9UNQ0 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
RAB9A P51151 2/20 0.40
LMNA P02545 1/20 0.40
GAA P10253 1/20 0.40
THRB P10828 1/20 0.40
RECQL P46063 1/20 0.40
BLM P54132 1/20 0.40

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
SCHEMBL7669246 0.89 ALDH1A1 (0.46) ALDH1A1KDM4EMAPTL3MBTL1NPSR1
SCHEMBL16951229 0.86 ALDH1A1 (0.43) ALDH1A1MAPTL3MBTL1TSHRATM
SCHEMBL16953073 0.86 KMT2A (0.51) ALDH1A1KDM4EL3MBTL1TSHRKMT2A
SCHEMBL27981326 0.85 L3MBTL1 (0.55) ALDH1A1KDM4EMAPTL3MBTL1NPSR1
SCHEMBL95873 0.85 ALDH1A1 (0.53) ALDH1A1KDM4EL3MBTL1TSHRMEN1
SCHEMBL1057947 0.83 ALDH1A1 (0.43) ALDH1A1KDM4EMAPTL3MBTL1NPSR1
SCHEMBL19612335 0.82 ALDH1A1 (0.50) ALDH1A1KDM4EMAPTL3MBTL1NPSR1
SCHEMBL5572974 0.82 ABCB1 (0.48) ALDH1A1KDM4EMAPTL3MBTL1NPSR1
SCHEMBL16957328 0.81 CYP4F2 (0.42) ALDH1A1MAPTL3MBTL1NPSR1MEN1
SCHEMBL129790 0.80 ALDH1A1 (0.46) ALDH1A1KDM4EMAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2900645-A1 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION Bayer CropScience AG (DE) 2015-08-05 EP disclosed
US-8008525-B2 For the 14273 peroxisome proliferator activated receptor; antidiabetic agents, hyperlipidemia, obesity or anorexia; receptor binding assay; drug screening kits TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-08-30 US disclosed
US-8008525-B2 For the 14273 peroxisome proliferator activated receptor; antidiabetic agents, hyperlipidemia, obesity or anorexia; receptor binding assay; drug screening kits TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-08-30 US disclosed
US-8008525-B2 For the 14273 peroxisome proliferator activated receptor; antidiabetic agents, hyperlipidemia, obesity or anorexia; receptor binding assay; drug screening kits TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-08-30 US disclosed
US-20080167378-A1 Receptor Function Regulation Agent TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-07-10 US disclosed
US-20080167378-A1 Receptor Function Regulation Agent TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-07-10 US disclosed
US-20080167378-A1 Receptor Function Regulation Agent TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-07-10 US disclosed
US-7304057-B2 Substituted 6-membered N-heterocyclic compounds and method for their use as neurological regulator Institute of Pharmacology and Toxicology Accademy of Military Medical Sciences P.L.A. China (CN) 2007-12-04 US disclosed
EP-1688138-A1 RECEPTOR FUNCTION REGULATING AGENT Takeda Pharmaceutical Company Limited (JP) 2006-08-09 EP disclosed
US-20050130958-A1 Substituted 6−membered n−heterocyclic compounds and their uses as neurological regulator INSTITUTE OF PHARMACOLOGY AND TOXICOLOGY ACADEMY OF MILITARY MEDICAL SCIENCES P.L.A. CHINA (CN) 2005-06-16 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 (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-20080167378-A1 Receptor Function Regulation Agent GPR119, INSR, GPR88 ALDH1A1 3163/4885KDM4E 2595/4885MAPT 4788/4885
US-20050130958-A1 Substituted 6−membered n−heterocyclic compounds and their uses as neurological regulator BDNF, NGF, NTRK2 ALDH1A1 3864/4885KDM4E 3082/4885MAPT 274/4885

“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.