SCHEMBL9058427

SCHEMBL9058427

CC(C)(C)c1ccc(-c2nc3ccc(-c4ccc5nc(C(C)(C)C)[nH]c5c4)cc3[nH]2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 2/20 0.62
▸ TRPV1 Q8NER1 3/20 0.61
▸ NPBWR1 P48145 3/20 0.61
▸ SCD O00767 1/20 0.56
▸ KCNH2 Q12809 3/20 0.55
▸ SCN10A Q9Y5Y9 2/20 0.55
▸ DGAT1 O75907 2/20 0.50
▸ TNKS O95271 1/20 0.49
▸ PARP1 P09874 1/20 0.49
▸ TNKS2 Q9H2K2 1/20 0.49
▸ MEN1 O00255 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ GMNN O75496 1/20 0.49
▸ USP2 O75604 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ GLA P06280 1/20 0.49
▸ POLB P06746 1/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ MAPT P10636 1/20 0.49

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
SCHEMBL26358087 0.95 HDAC6 (0.60) HDAC6TRPV1NPBWR1SCDKCNH2
SCHEMBL18629758 0.92 TRPV1 (0.63) HDAC6TRPV1NPBWR1SCD
SCHEMBL12250680 0.91 HDAC6 (0.61) HDAC6TRPV1NPBWR1SCDKCNH2
SCHEMBL15746239 0.91 SCN10A (0.60) HDAC6TRPV1NPBWR1SCDKCNH2
SCHEMBL13536940 0.88 NPBWR1 (0.49) HDAC6TRPV1NPBWR1SCDKCNH2
SCHEMBL22326618 0.88 SCN10A (0.55) HDAC6TRPV1NPBWR1SCDKCNH2
SCHEMBL26357523 0.84 HDAC6 (0.51) HDAC6TRPV1NPBWR1SCDKCNH2
SCHEMBL9915005 0.82 HDAC6 (0.49) HDAC6TRPV1NPBWR1SCDKCNH2
SCHEMBL19190854 0.82 CHEK2 (0.64) TRPV1KDM4EUSP2ALDH1A1MAPT
SCHEMBL846652 0.81 SCN10A (0.78) SCDKCNH2SCN10AALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8507148-B2 Benzoxazine-based monomer, polymer thereof, electrode for fuel cell including the polymer, electrolyte membrane for fuel cell including the polymer, and fuel cell using the electrode SAMSUNG ELECTRONICS CO., LTD. (KR) 2013-08-13 — — US disclosed
US-20120251920-A1 BENZOXAZINE-BASED MONOMER, POLYMER THEREOF, ELECTRODE FOR FUEL CELL INCLUDING THE POLYMER, ELECTROLYTE MEMBRANE FOR FUEL CELL INCLUDING THE POLYMER, AND FUEL CELL USING THE ELECTRODE SAMSUNG ELECTRONICS CO., LTD. (KR) 2012-10-04 — — US disclosed
US-20120251920-A1 BENZOXAZINE-BASED MONOMER, POLYMER THEREOF, ELECTRODE FOR FUEL CELL INCLUDING THE POLYMER, ELECTROLYTE MEMBRANE FOR FUEL CELL INCLUDING THE POLYMER, AND FUEL CELL USING THE ELECTRODE SAMSUNG ELECTRONICS CO., LTD. (KR) 2012-10-04 — — US disclosed
US-8187766-B2 Benzoxazine-based monomer, polymer thereof, electrode for fuel cell including the polymer, electrolyte membrane for fuel cell including the polymer, and fuel cell using the electrode SAMSUNG ELECTRONICS CO., LTD. (KR) 2012-05-29 — — US disclosed
US-20090117440-A1 BENZOXAZINE-BASED MONOMER, POLYMER THEREOF, ELECTRODE FOR FUEL CELL INCLUDING THE POLYMER, ELECTROLYTE MEMBRANE FOR FUEL CELL INCLUDING THE POLYMER, AND FUEL CELL USING THE ELECTRODE SAMSUNG ELECTRONICS CO., LTD. (KR) 2009-05-07 — — 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-20090117440-A1 BENZOXAZINE-BASED MONOMER, POLYMER THEREOF, ELECTRODE FOR FUEL CELL INCLUDING THE POLYMER, ELECTROLYTE MEMBRANE FOR FUEL CELL INCLUDING THE POLYMER, AND FUEL CELL USING THE ELECTRODE HCN1, PXMP4, GJA1 HDAC6 3917/4885TRPV1 918/4885NPBWR1 982/4885
US-20120251920-A1 BENZOXAZINE-BASED MONOMER, POLYMER THEREOF, ELECTRODE FOR FUEL CELL INCLUDING THE POLYMER, ELECTROLYTE MEMBRANE FOR FUEL CELL INCLUDING THE POLYMER, AND FUEL CELL USING THE ELECTRODE HCN1, PXMP4, GJA1 HDAC6 3917/4885TRPV1 918/4885NPBWR1 982/4885

“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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