SCHEMBL2165047

SCHEMBL2165047

OB(O)c1ccc2cc(-c3cccc4ccccc34)ccc2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.59
CA2 P00918 4/20 0.59
MCL1 Q07820 2/20 0.47
ACMSD Q8TDX5 1/20 0.47
CA12 O43570 2/20 0.42
CA9 Q16790 2/20 0.42
HDAC8 Q9BY41 2/20 0.42
HDAC6 Q9UBN7 1/20 0.42
HDAC4 P56524 1/20 0.41
HDAC2 Q92769 1/20 0.41
MGLL Q99685 2/20 0.41
GSTP1 P09211 1/20 0.41
PPARG P37231 5/20 0.40
PPARA Q07869 5/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
PPARD Q03181 1/20 0.40
PIM1 P11309 1/20 0.40
ESR2 Q92731 1/20 0.40
EDNRB P24530 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
SCHEMBL1093598 0.92 CA1 (0.62) CA1CA2MCL1ACMSDHDAC8
SCHEMBL29306850 0.88 CA1 (0.53) CA1CA2MCL1ACMSDCA12
SCHEMBL13016334 0.88 CA1 (0.49) CA1CA2MCL1ACMSDCA12
SCHEMBL2475284 0.86 CA1 (0.50) CA1CA2MCL1ACMSDHDAC8
SCHEMBL28415941 0.86 MCL1 (0.46) CA1CA2MCL1ACMSDCA12
SCHEMBL622947 0.85 MGLL (0.58) CA1CA2MCL1ACMSDCA12
SCHEMBL29610130 0.85 MGLL (0.58) CA1CA2MCL1ACMSDCA12
SCHEMBL29384733 0.84 CA1 (0.52) CA1CA2MCL1ACMSDCA12
SCHEMBL431998 0.84 CA1 (0.52) CA1CA2MCL1ACMSDCA12
SCHEMBL31742566 0.84 MCL1 (0.54) CA1CA2MCL1ACMSDCA12

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
US-9024304-B2 Naphthalene derivative, organic material including the same, and organic electroluminescent device including the same DAE JOO ELECTRONIC MATERIALS CO., LTD. (KR) 2015-05-05 US disclosed
US-20140299849-A1 NAPHTHALENE DERIVATIVE, ORGANIC MATERIAL INCLUDING THE SAME, AND ORGANIC ELECTROLUMINESCENT DEVICE INCLUDING THE SAME DAE JOO ELECTRONIC MATERIALS CO., LTD. (KR) 2014-10-09 US disclosed
EP-2692823-A2 NAPHTHALENE DERIVATIVES, ORGANIC MATERIAL USING SAME, AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME Dae Joo Electronic Materials Co., Ltd. (KR) 2014-02-05 EP disclosed
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-7985491-B2 Anthrylarylene derivative, material for organic electroluminescence device and organic electroluminescence device using same IDEMITSU KOSAN CO., LTD. (JP) 2011-07-26 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
EP-1864962-A1 ANTHRYLARYLENE DERIVATIVE, MATERIAL FOR ORGANIC ELECTROLUMINESCENT DEVICE, AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2007-12-12 EP disclosed
US-20070088185-A1 Anthrylarylene derivative, material for organic electroluminescence device and organic electroluminescence device using same IDEMITSU KOSAN CO., LTD. (JP) 2007-04-19 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-20090008607-A1 NAPHTHALENE DERIVATIVE, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICE, AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME CCNL2, ARL1, CCNA1 CA1 2406/4885CA2 2757/4885MCL1 1881/4885
US-20070088185-A1 Anthrylarylene derivative, material for organic electroluminescence device and organic electroluminescence device using same RABGGTA, ALAD, GCDH CA1 2317/4885CA2 1858/4885MCL1 2875/4885

“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.