SCHEMBL990710

SCHEMBL990710

O=[N+]([O-])c1c[nH]c(-c2ccccc2)n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.48
▸ RAB9A P51151 3/20 0.48
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ NPBWR1 P48145 2/20 0.48
▸ NPC1 O15118 2/20 0.48
▸ KMT2A Q03164 6/20 0.44
▸ MEN1 O00255 4/20 0.44
▸ LMNA P02545 3/20 0.44
▸ GUSB P08236 2/20 0.40
▸ TNKS O95271 1/20 0.40
▸ NLRP3 Q96P20 1/20 0.40
▸ TNKS2 Q9H2K2 1/20 0.40
▸ PARP2 Q9UGN5 1/20 0.40
▸ MMP2 P08253 1/20 0.40
▸ MMP9 P14780 1/20 0.40
▸ MMP8 P22894 1/20 0.40
▸ ELANE P08246 1/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ CHEK2 O96017 1/20 0.38

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
SCHEMBL28920099 0.82 ALDH1A1 (0.33) MAPTRAB9ASMN1; SMN2NPBWR1NPC1
SCHEMBL2227297 0.77 METAP1 (0.52) MAPTRAB9ASMN1; SMN2NPC1KMT2A
SCHEMBL12881747 0.76 ALDH1A1 (0.57) MAPTRAB9ASMN1; SMN2NPBWR1NPC1
SCHEMBL7145501 0.76 MMP2 (0.51) MAPTRAB9ASMN1; SMN2NPBWR1NPC1
SCHEMBL11843651 0.75 MAPT (0.36) MAPTRAB9ASMN1; SMN2NPC1ALDH1A1
SCHEMBL19877854 0.75 KDM4E (0.52) MAPTRAB9ASMN1; SMN2NPBWR1NPC1
SCHEMBL9627673 0.72 — —
SCHEMBL6054864 0.71 RIPK1 (0.51) MAPTSMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL7838930 0.71 CYP3A4 (0.36) MAPTRAB9ASMN1; SMN2NPBWR1NPC1
SCHEMBL5578303 0.71 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240327444-A1 Method for Purifying Nucleotides, Device for Purifying Nucleotides, Hy-Drophobic Reagent, and Hydrophobic Substrate JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2024-10-03 — — US disclosed
EP-4368628-A1 METHOD FOR PURIFYING NUCLEOTIDES, DEVICE FOR PURIFYING NUCLEOTIDES, HYDROPHOBIC REAGENT, AND HYDROPHOBIC SUBSTRATE Japan Science and Technology Agency (JP) 2024-05-15 — — EP disclosed
CN-117858885-A Method and device for purifying nucleotide, and hydrophobic reagent and hydrophobic substrate 国立研究开发法人科学技术振兴机构 2024-04-09 — — CN disclosed
WO-2023282245-A1 METHOD FOR PURIFYING NUCLEOTIDES, DEVICE FOR PURIFYING NUCLEOTIDES, HYDROPHOBIC REAGENT, AND HYDROPHOBIC SUBSTRATE 国立研究開発法人科学技術振興機構 2023-01-12 — — WO disclosed
US-9834542-B2 LXR modulators BRISTO-MYERS SQUIBB COMPANY (US) 2017-12-05 — — US disclosed
EP-2968275-B1 LXR MODULATORS BRISTOL MYERS SQUIBB CO (US) 2017-11-29 — — EP disclosed
US-20160304499-A1 LXR MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2016-10-20 — — US disclosed
EP-2968275-A1 LXR MODULATORS Bristol-Myers Squibb Company (US) 2016-01-20 — — EP disclosed
WO-2014144037-A1 LXR MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2014-09-18 — — WO disclosed
US-7863310-B2 Kinase inhibitors ELI LILLY AND COMPANY (US) 2011-01-04 — — US disclosed
EP-1417204-A1 ORTHO-HETEROCYCLIC SUBSTITUTED ARYL AMIDES FOR CONTROLLING INVERTEBRATE PESTS E. I. du Pont de Nemours and Company (US) 2004-05-12 — — EP disclosed
US-6627647-B1 Substituted 1-(4-aminophenyl)imidazoles and their use as anti-inflammatory agents BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. 2003-09-30 — — US disclosed
WO-2003026664-A1 2-PHENYLAMINO-4- (5-PYRAZOLYLAMINO) -PYRAMIDINE DERIVATIVES AS KINASE INHIBITORS, IN PARTICULAR, SRC KINASE INHIBITORS BAYER CORPORATION (US) 2003-04-03 — — WO disclosed
WO-2003016304-A1 ORTHO-HETEROCYCLIC SUBSTITUTED ARYL AMIDES FOR CONTROLLING INVERTEBRATE PESTS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2003-02-27 — — WO disclosed
WO-2001070703-A2 SUBSTITUTED 1-(4-AMINOPHENYL)IMIDAZOLES AND THEIR USE AS ANTI-INFLAMMATORY AGENTS BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2001-09-27 — — WO disclosed
EP-0365907-A1 Process for the preparation of p-nitrophenyl imidazoles BASF Aktiengesellschaft (DE) 1990-05-02 — — EP disclosed
EP-0131973-B1 NEW AMIDINE DERIVATIVES OF 2-SUBSTITUTED 4-PHENILIMIDAZOLE ISTITUTO DE ANGELI S.p.A. (IT) 1989-08-02 — — EP disclosed
US-4649150-A ANTISECRETORY AGENTS ISTITUTO DE ANGELI, S.P.A. (IT) 1987-03-10 — — US disclosed
EP-0131973-A1 New amidine derivatives of 2-substituted 4-phenilimidazole ISTITUTO DE ANGELI S.p.A. (IT) 1985-01-23 — — EP disclosed
US-4272538-A 5-Nitro-imidazole with antiprotozoic activity ROTTA RESEARCH LABORATORIUM S.P.A. (IT) 1981-06-09 — — 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-20160304499-A1 LXR MODULATORS NR1H2, NR1H3, NR1H4 MAPT 3581/4885RAB9A 3452/4885SMN1; SMN2 4731/4885
US-20240327444-A1 Method for Purifying Nucleotides, Device for Purifying Nucleotides, Hy-Drophobic Reagent, and Hydrophobic Substrate NUDT1, SAMHD1, PNP MAPT 4208/4885RAB9A 3139/4885SMN1; SMN2 2055/4885

“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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