SCHEMBL68630

SCHEMBL68630

COC(=O)c1cccc2c1oc1c(C(=O)OC)cccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.50
TSHR P16473 1/20 0.50
ALDH1A1 P00352 1/20 0.48
CFTR P13569 1/20 0.48
HSD17B10 Q99714 1/20 0.48
KDM4E B2RXH2 3/20 0.47
POLB P06746 1/20 0.47
ATM Q13315 1/20 0.47
NR4A2 P43354 4/20 0.46
MAP2K1 Q02750 1/20 0.46
CREBBP Q92793 1/20 0.46
KMT2A Q03164 2/20 0.44
HTT P42858 1/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA9 Q16790 2/20 0.44
CA12 O43570 1/20 0.44
CA7 P43166 1/20 0.44
CA14 Q9ULX7 1/20 0.44
BRD4 O60885 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
Aniline SCHEMBL3829674 0.89 ALDH1A1 (0.51) LMNATSHRALDH1A1CFTRHSD17B10
SCHEMBL516174 0.88 KDM4E (0.53) LMNATSHRALDH1A1CFTRHSD17B10
SCHEMBL4160534 0.86 LMNA (0.39) LMNATSHRALDH1A1CFTRHSD17B10
SCHEMBL10547539 0.84 NR4A2 (0.44) LMNATSHRALDH1A1CFTRHSD17B10
SCHEMBL3831506 0.84 TSHR (0.47) LMNATSHRALDH1A1CFTRHSD17B10
SCHEMBL3965291 0.83 KMT2A (0.44) LMNATSHRALDH1A1CFTRHSD17B10
SCHEMBL28853940 0.82 NR4A2 (0.42) LMNATSHRALDH1A1CFTRHSD17B10
SCHEMBL70429 0.81 LMNA (0.59) LMNATSHRALDH1A1CFTRHSD17B10
SCHEMBL3384509 0.81 KDM4E (0.61) LMNAALDH1A1HSD17B10KDM4EPOLB
SCHEMBL10550563 0.81 GAA (0.50) LMNATSHRALDH1A1CFTRHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2479203-A1 AROMATIC POLYESTER Muroran Institute of Technology (JP) 2012-07-25 EP disclosed
US-20120172570-A1 AROMATIC POLYESTER NITTA CORPORATION 2012-07-05 US disclosed
US-8129493-B2 Aromatic polyester MURORAN INSTITUTE OF TECHNOLOGY (JP) 2012-03-06 US disclosed
US-20110224343-A1 MODIFIER FOR AROMATIC POLYESTER AND AROMATIC POLYESTER RESIN COMPOSITION COMPRISING THE SAME MURORAN INSTITUTE OF TECHNOLOGY (JP) 2011-09-15 US disclosed
US-20110092662-A1 AROMATIC POLYESTER NITTA CORPORATION (JP) 2011-04-21 US disclosed
EP-2061755-A1 TRICYCLIC COMPOUNDS USEFUL IN TREATING IRON DISORDERS XENON PHARMACEUTICALS INC. (CA) 2009-05-27 EP disclosed
US-20090069408-A1 TRICYCLIC COMPOUNDS USEFUL IN TREATING IRON DISORDERS XENON PHARMACEUTICALS INC. (CA) 2009-03-12 US disclosed
WO-2008109840-A1 TRICYCLIC COMPOUNDS USEFUL IN TREATING IRON DISORDERS XENON PHARMACEUTICALS INC. (CA) 2008-09-12 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 (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-20110224343-A1 MODIFIER FOR AROMATIC POLYESTER AND AROMATIC POLYESTER RESIN COMPOSITION COMPRISING THE SAME F12, PHAX, WDR82 LMNA 2207/4885TSHR 3263/4885ALDH1A1 1882/4885
US-20090069408-A1 TRICYCLIC COMPOUNDS USEFUL IN TREATING IRON DISORDERS TFRC, SLC40A1, FECH LMNA 1774/4885TSHR 121/4885ALDH1A1 1638/4885

“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.