SCHEMBL5584500

SCHEMBL5584500

CC[CH]c1cccc(Cl)c1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.44
▸ LMNA P02545 3/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ PPP1R15A O75807 1/20 0.43
▸ MELK Q14680 1/20 0.43
▸ PPP1R15B Q5SWA1 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ PNMT P11086 2/20 0.41
▸ TAS1R3 Q7RTX0 1/20 0.40
▸ TAS1R1 Q7RTX1 1/20 0.40
▸ TAS1R2 Q8TE23 1/20 0.40
▸ TSHR P16473 1/20 0.39
▸ PTGS2 P35354 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ NFKB1 P19838 1/20 0.38
▸ TAAR1 Q96RJ0 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
SCHEMBL8379850 0.85 LMNA (0.41) ALDH1A1LMNASMN1; SMN2L3MBTL1PPP1R15A
SCHEMBL10708111 0.82 DRD3 (0.40) ALDH1A1LMNASMN1; SMN2L3MBTL1PPP1R15A
SCHEMBL1157213 0.81 ALDH1A1 (0.52) ALDH1A1LMNASMN1; SMN2L3MBTL1TSHR
SCHEMBL9317682 0.80 PPP1R15A (0.46) ALDH1A1LMNASMN1; SMN2L3MBTL1PPP1R15A
SCHEMBL10680668 0.79 ALDH1A1 (0.40) ALDH1A1LMNASMN1; SMN2L3MBTL1PPP1R15A
SCHEMBL16951342 0.78 DRD2 (0.43) ALDH1A1LMNASMN1; SMN2L3MBTL1PPP1R15A
SCHEMBL16951865 0.77 SMN1; SMN2 (0.47) ALDH1A1LMNASMN1; SMN2L3MBTL1PPP1R15A
SCHEMBL1547373 0.76 L3MBTL1 (0.46) ALDH1A1LMNASMN1; SMN2L3MBTL1PPP1R15A
SCHEMBL3302004 0.75 PPP1R15A (0.48) ALDH1A1LMNASMN1; SMN2L3MBTL1PPP1R15A
SCHEMBL16960825 0.75 L3MBTL1 (0.39) ALDH1A1LMNASMN1; SMN2L3MBTL1PPP1R15A

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
US-7211577-B2 Water-soluble phenylpyridazine derivative and medicine containing the same KOWA CO., LTD. (JP) 2007-05-01 — — US claimed
US-20060142292-A1 4-(4-tert-butoxycarbonyl-1-piperazinyl)methyl-6-(3-fluoro-4-methylphenyl)-2-isobutyl-2H-pyridazin-3-one;inhibiting interleukin-1 beta, high water solubility and oral absorbability; treating immune system diseases, inflammatory diseases, and ischemic diseases KOWA CO., LTD. (JP) 2006-06-29 — — US claimed
EP-1604984-A1 WATER-SOLUBLE PHENYLPYRIDAZINE DERIVATIVE AND MEDICINE CONTAINING THE SAME Kowa Co., Ltd. (JP) 2005-12-14 — — EP claimed
US-20040002497-A1 Water-soluble phenylpyridazine compounds and compositions containing the same KOWA CO., LTD. (JP) 2004-01-01 — — US claimed
US-7211577-B2 Water-soluble phenylpyridazine derivative and medicine containing the same KOWA CO., LTD. (JP) 2007-05-01 — — US disclosed
US-20060142292-A1 4-(4-tert-butoxycarbonyl-1-piperazinyl)methyl-6-(3-fluoro-4-methylphenyl)-2-isobutyl-2H-pyridazin-3-one;inhibiting interleukin-1 beta, high water solubility and oral absorbability; treating immune system diseases, inflammatory diseases, and ischemic diseases KOWA CO., LTD. (JP) 2006-06-29 — — US disclosed
EP-1604984-A1 WATER-SOLUBLE PHENYLPYRIDAZINE DERIVATIVE AND MEDICINE CONTAINING THE SAME Kowa Co., Ltd. (JP) 2005-12-14 — — EP disclosed
US-6861428-B2 Water-soluble phenylpyridazine compounds and compositions containing the same KOWA CO., LTD. (JP) 2005-03-01 — — US disclosed
US-20040002497-A1 Water-soluble phenylpyridazine compounds and compositions containing the same KOWA CO., LTD. (JP) 2004-01-01 — — US disclosed
US-6005116-A HAVE INHIBITION ACTIVITIES AGAINST TYPE A-MONOAMINE OXIDASE; TREATING OR PREVENTING DEPRESSION, PARKINSON'S DISEASE, ALZEHEIMER'S DEMENTIA, OR CEREBROVASCULAR DEMENTIA SANKYO COMPANY, LIMITED (JP) 1999-12-21 — — US disclosed
EP-0885891-A1 ISOXAZOLE DERIVATIVES SANKYO COMPANY LIMITED (JP) 1998-12-23 — — EP disclosed
EP-0193065-B1 Morpholine derivatives, processes for their production and their use as fungicides BASF AG (DE) 1995-08-23 — — EP disclosed
US-4967003-A Propylamines, and their use as fungicides BASF AKTIENGESELLSCHAFT (DE) 1990-10-30 — — US disclosed
US-4758564-A Ether and thioether amines and their use as fungicides BASF AKTIENGESELLSCHAFT (DE) 1988-07-19 — — US disclosed
US-4732989-A INTERMEDIATES FOR BACTERICIDES G. D. SEARLE & CO. (US) 1988-03-22 — — US disclosed
EP-0224163-A2 Propyl amines, process for their preparation and their use as fungicides BASF Aktiengesellschaft (DE) 1987-06-03 — — EP disclosed
US-4661602-A ANTIANAEROBIC AGENTS G. D. SEARLE & CO. (US) 1987-04-28 — — US disclosed
EP-0193065-A1 Morpholine derivatives, processes for their production and their use as fungicides BASF Aktiengesellschaft (DE) 1986-09-03 — — EP disclosed
US-4361688-A CATALYSTS FOR ADDITION POLYMERIZATION ARGUS CHEMICAL CORPORATION (US) 1982-11-30 — — US disclosed
US-4285877-A SOLID FREE RADICAL CATALYSTS; STORAGE STABILITY ARGUS CHEMICAL CORPORATION (US) 1981-08-25 — — 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-20060142292-A1 4-(4-tert-butoxycarbonyl-1-piperazinyl)methyl-6-(3-fluoro-4-methylphenyl)-2-isobutyl-2H-pyridazin-3-one;inhibiting interleukin-1 beta, high water solubility and oral absorbability; treating immune system diseases, inflammatory diseases, and ischemic diseases IL1B, IL1A, IL1R1 ALDH1A1 434/4885LMNA 3006/4885SMN1; SMN2 3094/4885
US-20040002497-A1 Water-soluble phenylpyridazine compounds and compositions containing the same IL1A, IL1B, IL1R1 ALDH1A1 174/4885LMNA 3723/4885SMN1; SMN2 4722/4885

“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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