SCHEMBL441703

SCHEMBL441703

OB(O)c1ccc(-c2ccccc2)nc1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 2/20 0.54
CA1 P00915 2/20 0.54
CA2 P00918 2/20 0.54
LDHA P00338 1/20 0.52
BAZ2B Q9UIF8 1/20 0.45
CA4 P22748 1/20 0.44
CA6 P23280 1/20 0.44
CA5A P35218 1/20 0.44
CA7 P43166 1/20 0.44
ENPP2 Q13822 1/20 0.44
CA14 Q9ULX7 1/20 0.44
CA5B Q9Y2D0 1/20 0.44
CYP11B1 P15538 8/20 0.42
CYP11B2 P19099 8/20 0.42
HPGDS O60760 2/20 0.42

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
SCHEMBL29950578 1.00 MGLL (0.54) MGLLCA1CA2LDHABAZ2B
SCHEMBL28718108 0.84 MGLL (0.46) MGLLCA1CA2LDHABAZ2B
SCHEMBL38656446 0.83 ENPP2 (0.42) MGLLCA1CA2CA4CA6
SCHEMBL26314552 0.83 ENPP2 (0.42) MGLLCA1CA2CA4CA6
SCHEMBL25192631 0.82 CYP2A6 (0.57) CYP11B1CYP11B2
SCHEMBL30376699 0.82 CYP2A6 (0.57) CYP11B1CYP11B2
SCHEMBL2560337 0.81 NPC1 (0.53) MGLLCA1CA2CYP11B1CYP11B2
SCHEMBL30518373 0.81 NPC1 (0.53) MGLLCA1CA2CYP11B1CYP11B2
SCHEMBL14668828 0.81 CA2 (0.54) MGLLCA1CA2
SCHEMBL19780935 0.81 ENPP2 (0.54) MGLLCA1CA2ENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114249685-A Ortho-diaryl substituted phenanthrene or phenanthroline carrier transport material and preparation method and application thereof 华南理工大学 2022-03-29 CN claimed
US-20260078104-A1 ORGANIC LIGHT-EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME SOLUS ADVANCED MATERIALS CO., LTD. (KR) 2026-03-19 US disclosed
US-12545656-B2 Organic light-emitting compound and organic electroluminescent device using the same SOLUS ADVANCED MATERIALS CO., LTD. (KR) 2026-02-10 US disclosed
US-20260040756-A1 Compound, Organic Semiconducting Material Comprising the Same, Organic Electronic Device Comprising the Same and Display Device Comprising the Same NOVALED GMBH (DE) 2026-02-05 US disclosed
CN-119698411-A Compound, organic semiconductor material comprising the same, organic electronic device comprising the same, and display device comprising the same 诺瓦尔德股份有限公司 2025-03-25 CN disclosed
CN-119591542-A ADAR1 small molecule inhibitor, pharmaceutical composition and application thereof 深圳市新樾生物科技有限公司 2025-03-11 CN disclosed
WO-2025009539-A1 COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT MATERIAL, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2025-01-09 WO disclosed
EP-4472956-A1 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE, COMPOSITIONS, AND METHODS OF USE Bristol-Myers Squibb Company (US) 2024-12-11 EP disclosed
US-12162848-B2 Inhibitors of protein tyrosine phosphatase, compositions, and methods of use BRISTOL-MYERS SQUIBB COMPANY (US) 2024-12-10 US disclosed
CN-118702627-A CD73 small molecule inhibitor, pharmaceutical composition and application thereof 深圳市新樾生物科技有限公司 2024-09-27 CN disclosed
US-20110288295-A1 1,3,5-TRIAZINE DERIVATIVE, PROCESS FOR PRODUCING SAME, AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME SAGAMI CHEMICAL RESEARCH INSTITUTE (JP) 2011-11-24 US disclosed
US-20110288295-A1 1,3,5-TRIAZINE DERIVATIVE, PROCESS FOR PRODUCING SAME, AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME SAGAMI CHEMICAL RESEARCH INSTITUTE (JP) 2011-11-24 US disclosed
EP-2361909-A1 1,3,5-TRIAZINE DERIVATIVE, PROCESS FOR PRODUCING SAME, AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME Tosoh Corporation (JP) 2011-08-31 EP disclosed
EP-2361909-A1 1,3,5-TRIAZINE DERIVATIVE, PROCESS FOR PRODUCING SAME, AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME Tosoh Corporation (JP) 2011-08-31 EP disclosed
US-20110124808-A1 POLYMERIC COMPOUND CONTAINING METAL COMPLEX RESIDUE AND ELEMENT COMPRISING SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-05-26 US disclosed
US-20110124808-A1 POLYMERIC COMPOUND CONTAINING METAL COMPLEX RESIDUE AND ELEMENT COMPRISING SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-05-26 US disclosed
WO-2010118029-A1 METAL COMPLEX COMPRISING NOVEL LIGAND STRUCTURES UNIVERSAL DISPLAY CORPORATION (US) 2010-10-14 WO disclosed
WO-2010118029-A1 METAL COMPLEX COMPRISING NOVEL LIGAND STRUCTURES UNIVERSAL DISPLAY CORPORATION (US) 2010-10-14 WO disclosed
EP-0541081-B1 Compounds with only a side chain for use in liquid crystal mixtures AVENTIS RES & TECH GMBH & CO (DE) 2002-04-10 EP disclosed
US-5849216-A Compounds for use in liquid-crystal mixtures HOECHST AKTIENGESELLSCHAFT (DE) 1998-12-15 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 (6 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-20110288295-A1 1,3,5-TRIAZINE DERIVATIVE, PROCESS FOR PRODUCING SAME, AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME VDAC1, MT-ND5, TRPC5 MGLL 4044/4885CA1 3389/4885CA2 1991/4885
US-20110124808-A1 POLYMERIC COMPOUND CONTAINING METAL COMPLEX RESIDUE AND ELEMENT COMPRISING SAME ZRANB2, ZKSCAN2, SLC39A3 MGLL 4032/4885CA1 309/4885CA2 668/4885
US-12545656-B2 Organic light-emitting compound and organic electroluminescent device using the same ELOVL1, EPB41L2, L1CAM MGLL 2758/4885CA1 3308/4885CA2 3094/4885
US-12162848-B2 Inhibitors of protein tyrosine phosphatase, compositions, and methods of use PTPN2, PTPN22, PTPN5 MGLL 515/4885CA1 4536/4885CA2 1627/4885
US-20260040756-A1 Compound, Organic Semiconducting Material Comprising the Same, Organic Electronic Device Comprising the Same and Display Device Comprising the Same OR10J3, CCR1, CCR6 MGLL 1132/4885CA1 3807/4885CA2 3541/4885
US-20260078104-A1 ORGANIC LIGHT-EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME ELOC, ELOVL1, EMC1 MGLL 1304/4885CA1 1997/4885CA2 1787/4885

“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.