SCHEMBL5754367

SCHEMBL5754367

CCOP(=O)(OCC)C(c1ccc(C)cc1)c1ccc(C)cc1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA9 Q16790 1/20 0.49
POLB P06746 1/20 0.47
MAPT P10636 2/20 0.47
GAA P10253 1/20 0.46
NPSR1 Q6W5P4 2/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
LMNA P02545 2/20 0.43
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.40
EPHX2 P34913 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL6364168 0.93 POLB (0.58) CA12CA1CA2CA9POLB
SCHEMBL26999436 0.85 MAPT (0.40) CA12CA1CA2CA9POLB
SCHEMBL7088667 0.85 CA12 (0.49) CA12CA1CA2CA9POLB
SCHEMBL13321997 0.85 POLB (0.66) POLBMAPTGAANPSR1MEN1
SCHEMBL4262591 0.83 KMT2A (0.55) CA12CA1CA2CA9POLB
SCHEMBL26999443 0.83 NPSR1 (0.44) CA12CA1CA2CA9POLB
SCHEMBL2281034 0.82 POLB (0.68) POLBMAPTNPSR1MEN1KMT2A
SCHEMBL23357398 0.82 PTPN2 (0.49) CA12CA1CA2CA9POLB
SCHEMBL9713112 0.81 POLB (0.72) CA12CA1CA2CA9POLB
SCHEMBL9483480 0.81 MAPT (0.48) CA12CA1CA2CA9POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1137326-B1 ORGANIC ELECTROLUMINESCENT ELEMENT NIPPON STEEL CHEMICAL CO (JP) 2006-07-05 EP disclosed
US-6878822-B2 Ethylene derivative having a nitrogen-containing 7-membered ring FUJI PHOTO FILM CO., LTD. (JP) 2005-04-12 US disclosed
US-20030065171-A1 Luminescent element material, luminescent element, ethylene derivative having n-containing 7-membered ring, and benzoazepine derivative FUJI PHOTO FILM CO., LTD. 2003-04-03 US disclosed
US-6413657-B1 FOR USE IN ELECTRICAL DEVICES AND IN ELECTROPHOTOGRAPHY PHOTORECEPTORS FUJI PHOTO FILM CO., LTD. (JP) 2002-07-02 US disclosed
EP-1137326-A1 ORGANIC ELECTROLUMINESCENT ELEMENT Nippon Steel Chemical Co., Ltd. (JP) 2001-09-26 EP disclosed
US-5270140-A Bisstyryl compound and the electrophotographic photoreceptors relating thereto KONICA CORPORATION (JP) 1993-12-14 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 (1 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-20030065171-A1 Luminescent element material, luminescent element, ethylene derivative having n-containing 7-membered ring, and benzoazepine derivative EPN1, ERLIN1, NUCB2 CA12 2196/4885CA1 763/4885CA2 2975/4885

“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.