SCHEMBL3784572

SCHEMBL3784572

Nc1cccc(-c2cc(N)ccc2O)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.51
MAOA P21397 1/20 0.50
PDE10A Q9Y233 1/20 0.48
MAP4K4 O95819 2/20 0.47
IKBKB O14920 1/20 0.47
CA1 P00915 3/20 0.46
CA2 P00918 3/20 0.46
CA12 O43570 2/20 0.46
CA9 Q16790 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
ALDH1A1 P00352 1/20 0.46
CA7 P43166 1/20 0.46
CA14 Q9ULX7 1/20 0.46
BACE1 P56817 2/20 0.44
CYP3A4 P08684 2/20 0.44
CASP1 P29466 2/20 0.44
RECQL P46063 1/20 0.44
CYP1A2 P05177 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
SCHEMBL6572438 0.88 PIK3CG (0.56) PDE10AMAP4K4CA1CA2CA12
Hydrochloric Acid SCHEMBL6776875 0.86 PIK3CG (0.54) PDE10AMAP4K4CA1CA2CA12
SCHEMBL900806 0.85 BACE1 (0.62) MCL1MAOAPDE10ACA1CA2
SCHEMBL30230742 0.85 BACE1 (0.62) MCL1MAOAPDE10ACA1CA2
SCHEMBL3790537 0.85 MAOA (0.52) MCL1MAOAMAP4K4IKBKBCA1
SCHEMBL6572167 0.85 TAAR1 (0.56) PDE10ABACE1HSD17B1HSD17B2KDM4E
SCHEMBL6572414 0.85 PDE10A (0.52) PDE10AMAP4K4CA12CA9TDP1
SCHEMBL6573352 0.85 ALOX5 (0.55) PDE10ACA1CA2CA12CA9
SCHEMBL16429067 0.85 KDM1A (0.51) MCL1MAOAMAP4K4IKBKBCA1
Hydrochloric Acid SCHEMBL6781673 0.83 PDE10A (0.50) PDE10AMAP4K4CA12CA9TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115000364-B Polyimide coated modified lithium ion battery anode active material, preparation method and application 北京化工大学常州先进材料研究院 2024-07-02 CN claimed
CN-117012923-A Polyimide coated sodium ion battery positive electrode material, preparation method thereof and sodium ion battery 陕西创普斯新能源科技有限公司 2023-11-07 CN claimed
CN-116914101-A Polyimide coated lithium ion battery positive electrode material, preparation method and application 北京化工大学常州先进材料研究院 2023-10-20 CN claimed
CN-115000364-A Polyimide-coated modified lithium ion battery negative electrode active material, preparation method and application 北京化工大学常州先进材料研究院 2022-09-02 CN claimed
CN-114864898-A Polyimide-coated lithium ion battery positive electrode active material, preparation method and application 北京化工大学常州先进材料研究院 2022-08-05 CN claimed
EP-1208077-B1 2-HYDROXY-5-AMINO-BIPHENYL-DERIVATIVES AND OXIDATIVE HAIR COLOURING AGENTS CONTAINING SAID COMPOUNDS WELLA AG (DE) 2004-04-21 EP claimed
CN-115000364-B Polyimide coated modified lithium ion battery anode active material, preparation method and application 北京化工大学常州先进材料研究院 2024-07-02 CN disclosed
CN-117012923-A Polyimide coated sodium ion battery positive electrode material, preparation method thereof and sodium ion battery 陕西创普斯新能源科技有限公司 2023-11-07 CN disclosed
CN-217426787-U Composite pole piece with multifunctional coating modification 国联汽车动力电池研究院有限责任公司 2022-09-13 CN disclosed
CN-115000364-A Polyimide-coated modified lithium ion battery negative electrode active material, preparation method and application 北京化工大学常州先进材料研究院 2022-09-02 CN disclosed
CN-114864898-A Polyimide-coated lithium ion battery positive electrode active material, preparation method and application 北京化工大学常州先进材料研究院 2022-08-05 CN disclosed
CN-114361382-A Composite pole piece with multifunctional coating modification and preparation method and application thereof 国联汽车动力电池研究院有限责任公司 2022-04-15 CN disclosed
US-20100087680-A1 METHOD FOR PRODUCING BIARYL COMPOUND SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2010-04-08 US disclosed
EP-1914221-A1 PROCESS FOR PRODUCING BIARYL COMPOUND Sumitomo Chemical Company, Limited (JP) 2008-04-23 EP disclosed
US-6749644-B2 DEVELOPER AND COUPLER; WIDE RANGE OF DIFFERENT COLOR SHADES FROM BLOND TO BROWN, PURPLE, VIOLET AND EVEN BLUE AND BLACK; INTENSITY WELLA AKTIENGESELLSCHAFT (DE) 2004-06-15 US disclosed
EP-1208077-B1 2-HYDROXY-5-AMINO-BIPHENYL-DERIVATIVES AND OXIDATIVE HAIR COLOURING AGENTS CONTAINING SAID COMPOUNDS WELLA AG (DE) 2004-04-21 EP disclosed
US-20020166180-A1 2-hydroxy-5-amino-biphenyl-derivatives and oxidative hair colouring agents containing said compounds HFC PRESTIGE INTERNATIONAL OPERATIONS SWITZERLAND SÀRL (CH) 2002-11-14 US disclosed
EP-1208077-A1 2-HYDROXY-5-AMINO-BIPHENYL-DERIVATIVES AND OXIDATIVE HAIR COLOURING AGENTS CONTAINING SAID COMPOUNDS Wella Aktiengesellschaft (DE) 2002-05-29 EP disclosed
WO-2002002507-A1 2-HYDROXY-5-AMINO-BIPHENYL-DERIVATIVES AND OXIDATIVE HAIR COLOURING AGENTS CONTAINING SAID COMPOUNDS WELLA AKTIENGESELLSCHAFT (DE) 2002-01-10 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-20100087680-A1 METHOD FOR PRODUCING BIARYL COMPOUND NISCH, BLVRB, BBOX1 MCL1 3100/4885MAOA 348/4885PDE10A 3386/4885
US-20020166180-A1 2-hydroxy-5-amino-biphenyl-derivatives and oxidative hair colouring agents containing said compounds AHR, KRT18, HMOX2 MCL1 1758/4885MAOA 107/4885PDE10A 4026/4885

“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.