Sugi Predict

Sugi Predict / Compounds / SCHEMBL10051901

SCHEMBL10051901

SCHEMBL10051901

c1ccc(-c2ccc(N(c3ccc(-c4cccc5ccccc45)cc3)c3ccc4ccc5c6ccccc6ccc5c4c3)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 2/20 0.45
▸ CA1 P00915 2/20 0.45
▸ CA2 P00918 2/20 0.45
▸ CA9 Q16790 2/20 0.45
▸ MCL1 Q07820 1/20 0.43
▸ ACMSD Q8TDX5 1/20 0.43
▸ HPRT1 P00492 1/20 0.40
▸ TNF P01375 1/20 0.39
▸ HDAC8 Q9BY41 1/20 0.38
▸ HDAC6 Q9UBN7 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ HIF1A Q16665 1/20 0.38
▸ CYP1B1 Q16678 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ PPARG P37231 6/20 0.38
▸ PPARA Q07869 6/20 0.38
▸ CYP2C9 P11712 2/20 0.37
▸ CYP2C19 P33261 2/20 0.37
▸ PPARD Q03181 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37

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
SCHEMBL26046001 0.96 CA12 (0.45) CA12CA1CA2CA9MCL1
SCHEMBL26054175 0.96 MCL1 (0.43) CA12CA1CA2CA9MCL1
SCHEMBL24029727 0.96 CA12 (0.43) CA12CA1CA2CA9MCL1
SCHEMBL25730820 0.96 HPRT1 (0.44) CA12CA1CA2CA9MCL1
SCHEMBL24372606 0.96 CA12 (0.41) CA12CA1CA2CA9MCL1
SCHEMBL25730790 0.96 MCL1 (0.46) CA12CA1CA2CA9MCL1
SCHEMBL26045566 0.94 MCL1 (0.44) CA12CA1CA2CA9MCL1
SCHEMBL26055383 0.94 CA12 (0.43) CA12CA1CA2CA9MCL1
SCHEMBL26054361 0.94 CA12 (0.48) CA12CA1CA2CA9MCL1
SCHEMBL26054829 0.94 CA12 (0.45) CA12CA1CA2CA9MCL1

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024014934-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DIODE, ORGANIC OPTOELECTRONIC DIODE AND DISPLAY DEVICE 삼성에스디아이 주식회사 2024-01-18 — — WO disclosed
EP-4235829-A1 ORGANIC LIGHT-EMITTING DEVICE Lg Chem, Ltd. (KR) 2023-08-30 — — EP disclosed
WO-2023153905-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DIODE, ORGANIC OPTOELECTRONIC DIODE, AND DISPLAY DEVICE 삼성에스디아이 주식회사 2023-08-17 — — WO disclosed
US-20220131083-A1 ORGANIC ELECTROLUMINESCENT COMPOUND, A PLURALITY OF HOST MATERIALS, AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD. (KR) 2022-04-28 — — US disclosed
US-8968883-B2 Chrysene derivative materials E I DU PONT DE NEMOURS AND COMPANY (US) 2015-03-03 — — US disclosed
US-8968883-B2 Chrysene derivative materials E I DU PONT DE NEMOURS AND COMPANY (US) 2015-03-03 — — US disclosed
US-20130187140-A1 CHRYSENE DERIVATIVE MATERIALS E I DU PONT DE NEMOURS AND COMPANY (US) 2013-07-25 — — US disclosed
US-20130187140-A1 CHRYSENE DERIVATIVE MATERIALS E I DU PONT DE NEMOURS AND COMPANY (US) 2013-07-25 — — US disclosed
US-20130126852-A1 PHOTOACTIVE COMPOSITION AND ELECTRONIC DEVICE MADE WITH THE COMPOSITION E I DU PONT DE NEMOURS AND COMPANY (US) 2013-05-23 — — US disclosed
US-20130126852-A1 PHOTOACTIVE COMPOSITION AND ELECTRONIC DEVICE MADE WITH THE COMPOSITION E I DU PONT DE NEMOURS AND COMPANY (US) 2013-05-23 — — US disclosed
US-20110147718-A1 ELECTROACTIVE COMPOSITION AND ELECTRONIC DEVICE MADE WITH THE COMPOSITION E.I. DU PONT DE NEMOURS AND COMPANY (US) 2011-06-23 — — US disclosed
WO-2011059807-A2 ORGANIC LIGHT-EMITTING DIODE LUMINAIRES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-05-19 — — WO disclosed
US-20110101316-A1 ORGANIC LIGHT-EMITTING DIODE LUMINAIRES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2011-05-05 — — US disclosed
US-20110101316-A1 ORGANIC LIGHT-EMITTING DIODE LUMINAIRES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2011-05-05 — — US disclosed
US-20110037381-A1 CHRYSENE DERIVATIVE MATERIALS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-02-17 — — US disclosed
US-20110037381-A1 CHRYSENE DERIVATIVE MATERIALS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-02-17 — — US disclosed
WO-2011019360-A1 CHRYSENE DERIVATIVE MATERIALS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-02-17 — — WO disclosed
US-20110037056-A1 PHOTOACTIVE COMPOSITION AND ELECTRONIC DEVICE MADE WITH THE COMPOSITION E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-02-17 — — US disclosed
US-20110037056-A1 PHOTOACTIVE COMPOSITION AND ELECTRONIC DEVICE MADE WITH THE COMPOSITION E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-02-17 — — US disclosed
WO-2010068865-A2 PHOTOACTIVE COMPOSITION AND ELECTRONIC DEVICE MADE WITH THE COMPOSITION E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-06-17 — — 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-20110037381-A1 CHRYSENE DERIVATIVE MATERIALS RIF1, CCNL2, ARL1 CA12 1584/4885CA1 1932/4885CA2 2024/4885
US-20220131083-A1 ORGANIC ELECTROLUMINESCENT COMPOUND, A PLURALITY OF HOST MATERIALS, AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME TELO2, TERT, LIMS1 CA12 3388/4885CA1 3153/4885CA2 3723/4885

“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.