SCHEMBL2513514

SCHEMBL2513514

OB(O)c1ccc(-c2ccc3cc(-c4ccccc4)ccc3c2)cc1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 3/20 0.75
▸ CA2 P00918 3/20 0.75
▸ MGLL Q99685 2/20 0.75
▸ ESR1 P03372 5/20 0.59
▸ ESR2 Q92731 5/20 0.59
▸ CA4 P22748 1/20 0.52
▸ CA6 P23280 1/20 0.52
▸ CA5A P35218 1/20 0.52
▸ CA7 P43166 1/20 0.52
▸ ENPP2 Q13822 1/20 0.52
▸ CA14 Q9ULX7 1/20 0.52
▸ CA5B Q9Y2D0 1/20 0.52
▸ TRPV1 Q8NER1 3/20 0.49
▸ HSD17B1 P14061 2/20 0.47
▸ HSD17B2 P37059 2/20 0.47
▸ ALOX5 P09917 2/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ CYP2D6 P10635 1/20 0.44
▸ CYP2C9 P11712 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
SCHEMBL20590197 0.94 CA1 (0.67) CA1CA2MGLLESR1ESR2
SCHEMBL2164297 0.94 CA1 (0.67) CA1CA2MGLLESR1ESR2
SCHEMBL1889241 0.92 CA1 (0.69) CA1CA2MGLLESR1ESR2
SCHEMBL29445737 0.92 CA1 (0.69) CA1CA2MGLLESR1ESR2
SCHEMBL2510400 0.92 CA1 (0.69) CA1CA2MGLLESR1ESR2
SCHEMBL2511888 0.88 CA1 (0.64) CA1CA2MGLLESR1ESR2
SCHEMBL31462160 0.88 CA1 (0.64) CA1CA2MGLLESR1ESR2
SCHEMBL28834033 0.88 CA1 (0.58) CA1CA2MGLLESR1ESR2
SCHEMBL12419993 0.87 CA1 (0.82) CA1CA2MGLLESR1CA4
SCHEMBL20955808 0.87 CA1 (0.82) CA1CA2MGLLESR1CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8034256-B2 Naphthalene derivative, material for organic electroluminescence device, and organic electroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2011-10-11 — — US disclosed
US-20090008607-A1 NAPHTHALENE DERIVATIVE, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICE, AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2009-01-08 — — US disclosed
US-20090008607-A1 NAPHTHALENE DERIVATIVE, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICE, AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2009-01-08 — — US disclosed
US-20090008607-A1 NAPHTHALENE DERIVATIVE, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICE, AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2009-01-08 — — 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-20090008607-A1 NAPHTHALENE DERIVATIVE, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICE, AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME CCNL2, ARL1, CCNA1 CA1 2406/4885CA2 2757/4885MGLL 3879/4885

“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.

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