SCHEMBL18686733

SCHEMBL18686733

CCCn1ccn(CCC)c1=O

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TYR P14679 1/20 0.41
▸ PDE4A P27815 8/20 0.39
▸ PDE4B Q07343 8/20 0.39
▸ PDE4C Q08493 8/20 0.39
▸ PDE4D Q08499 8/20 0.39
▸ ADORA2A P29274 5/20 0.39
▸ ADORA2B P29275 4/20 0.39
▸ PDE1A P54750 2/20 0.39
▸ PDE1B Q01064 2/20 0.39
▸ PDE1C Q14123 2/20 0.39
▸ GSK3A P49840 1/20 0.35
▸ GSK3B P49841 1/20 0.35
▸ CYP1A2 P05177 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ BLM P54132 1/20 0.34
▸ PMP22 Q01453 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ MGLL Q99685 1/20 0.33

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
SCHEMBL10044418 0.93 PDE4A (0.39) TYRPDE4APDE4BPDE4CPDE4D
SCHEMBL15906247 0.87 TYR (0.37) TYRPDE4APDE4BPDE4CPDE4D
SCHEMBL6678530 0.82 PTGS1 (0.48) ADORA2ACYP1A2CYP3A4HSD17B10ALDH1A1
SCHEMBL14516273 0.80 PDE4A (0.36) TYRPDE4APDE4BPDE4CPDE4D
SCHEMBL4623309 0.77 MAPT (0.39) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL7274815 0.75 PDE4A (0.39) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL25160404 0.74 ALDH1A1 (0.43) GSK3AGSK3BALDH1A1MGLL
SCHEMBL18686731 0.74 ALDH1A1 (0.42) TYRPDE4APDE4BPDE4CPDE4D
SCHEMBL10436903 0.74 LPO (0.34) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL4622254 0.72 ADORA2B (0.40) ADORA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10316111-B2 Conjugated diene-based polymer, method for producing the same, and composition including the same ASAHI KASEI KABUSHIKI KAISHA (JP) 2019-06-11 — — US claimed
CN-108693718-A Anticorrosive additive stripping liquid controlling composition 东友精细化工有限公司 2018-10-23 — — CN claimed
CN-103424999-A Resist stripper composition and method for manufacturing TFT array substrate using the same DONGWOO FINE CHEM CO LTD 2013-12-04 — — CN claimed
CN-101284848-B Synthetic method of clinic effect of alendronate CSPC PHARMACEUTICAL GROUP OUYI PHARMA CO LTD 2013-09-11 — — CN claimed
CN-102067358-A Lithium cell with cathode containing iron disulfide GILLETTE CO 2011-05-18 — — CN claimed
CN-101284848-A Synthetic method of clinic effect of alendronate SHIJIAZHUANG PHARM GROUP OUYI (CN) 2008-10-15 — — CN claimed
WO-2024101394-A1 HYDROGENATED CONJUGATED DIENE POLYMER, AND HYDROGENATED CONJUGATED DIENE POLYMER MANUFACTURING METHOD 旭化成株式会社 2024-05-16 — — WO disclosed
US-20230331894-A1 Molded Bale ASAHI KASEI KABUSHIKI KAISHA (JP) 2023-10-19 — — US disclosed
WO-2023171191-A1 CONJUGATED DIENE POLYMER, CONJUGATED DIENE POLYMER COMPOSITION, AND CONJUGATED DIENE POLYMER CROSSLINKED PRODUCT 旭化成株式会社 2023-09-14 — — WO disclosed
EP-4219191-A1 BALE-MOLDED ARTICLE Asahi Kasei Kabushiki Kaisha (JP) 2023-08-02 — — EP disclosed
WO-2023038095-A1 CROSSLINKED RUBBER COMPOSITION, METHOD FOR PRODUCING CROSSLINKED RUBBER COMPOSITION 日本エラストマー株式会社 2023-03-16 — — WO disclosed
WO-2022065509-A1 BALE-MOLDED ARTICLE 旭化成株式会社 2022-03-31 — — WO disclosed
US-20190233546-A1 Conjugated Diene-Based Polymer, Method for Producing the Same, and Composition Including the Same JAPAN ELASTOMER CO., LTD. (JP) 2019-08-01 — — US disclosed
CN-1464874-A Process for preparation of 1,5-diaminonaphthalenes MITSUI CHEMICALS INC (JP) 2003-12-31 — — CN disclosed
CN-1411502-A Detergent composition ARAKAWA CHEM IND (JP) 2003-04-16 — — CN disclosed
CN-1392889-A Polyvinyl alcohol resin composition and multilayer container KURARAY CO (JP) 2003-01-22 — — CN disclosed
CN-1056138-C Process for preparing diurea compounds MITSUI CHEMICALS INC (JP) 2000-09-06 — — CN disclosed
CN-1242363-A Process for producing 1,3-dialkyl-2-imidazolidinone MITSUI CHEMICALS INC (JP) 2000-01-26 — — CN disclosed
CN-1225495-A Electrolytic capacitor and method for making same MATSUSHITA ELECTRIC INDUSTRIAL CO LTD (JP) 1999-08-11 — — CN disclosed
CN-1176249-A High Purity 1, 3 -dialkyl -2 - imidazolidinone and preparation MITSUI TOATSU CHEMICALS (JP) 1998-03-18 — — CN disclosed
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