SCHEMBL8937797

SCHEMBL8937797

O=C(O)C(=O)NC1CCCCC1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.76
SMN1; SMN2 Q16637 5/20 0.76
RAB9A P51151 3/20 0.76
MAPT P10636 2/20 0.76
MAPK1 P28482 1/20 0.61
DUSP3 P51452 1/20 0.61
PTPN5 P54829 1/20 0.61
PTPN11 Q06124 1/20 0.61
EPHX1 P07099 7/20 0.61
ALDH1A1 P00352 2/20 0.61
KDM4E B2RXH2 1/20 0.61
CYP3A4 P08684 1/20 0.61
EPHX2 P34913 1/20 0.61
HTT P42858 2/20 0.53
GAA P10253 1/20 0.52
POLB P06746 1/20 0.52
MMP2 P08253 3/20 0.50
CA12 O43570 2/20 0.50
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50

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
SCHEMBL11410738 1.00 NPC1 (0.76) NPC1SMN1; SMN2RAB9AMAPTMAPK1
SCHEMBL11407159 1.00 NPC1 (0.76) NPC1SMN1; SMN2RAB9AMAPTMAPK1
SCHEMBL9456557 0.97 SMN1; SMN2 (0.71) NPC1SMN1; SMN2RAB9AMAPTMAPK1
SCHEMBL5026796 0.92 SMN1; SMN2 (0.64) NPC1SMN1; SMN2RAB9AMAPTMAPK1
SCHEMBL583921 0.87
SCHEMBL23736058 0.87 NPC1 (1.00) NPC1SMN1; SMN2RAB9AMAPTMAPK1
SCHEMBL3076504 0.87 NPC1 (1.00) NPC1SMN1; SMN2RAB9AMAPTMAPK1
SCHEMBL2377367 0.87 NPC1 (1.00) NPC1SMN1; SMN2RAB9AMAPTMAPK1
SCHEMBL8165938 0.87 NPC1 (1.00) NPC1SMN1; SMN2RAB9AMAPTMAPK1
SCHEMBL6850969 0.84 SMN1; SMN2 (0.94) NPC1SMN1; SMN2RAB9AMAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119350116-A Method for synthesizing itaconic acid compound 南京工业大学 2025-01-24 CN disclosed
CN-115385858-B Photocatalytic preparation method of 2-phenyl-2H-indazole-3-carboxamide compound 河南师范大学 2024-03-01 CN disclosed
CN-115403519-B Synthesis method of N-substituted isonicotinamide compound driven by visible light 河南师范大学 2024-03-01 CN disclosed
CN-116807914-A Oil control composition and application thereof in cosmetics 珠海姗拉娜化妆品有限公司 2023-09-29 CN disclosed
CN-115403519-A Synthesis method of N-substituted isonicotinamide compound driven by visible light 河南师范大学 2022-11-29 CN disclosed
EP-2670765-B1 C-17 AND C-3 MODIFIED TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY VIIV HEALTHCARE UK (NO 4) LTD (GB) 2017-10-18 EP disclosed
US-20160151387-A1 COMPOSITIONS HAVING C-17 AND C-3 MODIFIED TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY VIIV HEALTHCARE UK (NO. 4) LIMITED (GB) 2016-06-02 US disclosed
CN-103429607-B There is the triterpenoid that C-17 and C-3 of HIV maturation inhibit activities is modified BRISTOL-MYERS SQUIBB CO. (US) 2016-02-17 CN disclosed
US-20140343000-A1 COMPOSITIONS HAVING C-17 AND C-3 MODIFIED TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY VIIV HEALTHCARE UK (NO. 4) LIMITED (GB) 2014-11-20 US disclosed
US-8846647-B2 C-17 and C-3 modified triterpenoids with HIV maturation inhibitory activity BRISTOL-MYERS SQUIBB COMPANY (US) 2014-09-30 US disclosed
EP-0275317-B1 PROCESS FOR PRODUCING STEREOREGULAR POLYOLEFINS TOSOH CORPORATION (JP) 1990-11-28 EP disclosed
EP-0275317-A1 PROCESS FOR PRODUCING STEREOREGULAR POLYOLEFINS TOSOH CORPORATION (JP) 1988-07-27 EP disclosed
US-4617360-A SOLID CATALYST COMPLEX FROM OXYGEN-CONTAINING MAGNESIUM COMPOUNDS, OXYGEN-CONTAINING TITANUIM COMPOUNDS AND ORGANOALUMINUM HALIDE COMPOUNDS SOLVAY & CIE. (BE) 1986-10-14 US disclosed
US-4292200-A NON-HALIDE ORGANIC OXYGENATED COMPOUNDS OF MAGNESIUM AND TRANSITION METAL, ORGANOALUMINUM HALIDE SOLVAY & CIE (BE) 1981-09-29 US disclosed
EP-0000007-B1 PROCESS FOR THE POLYMERISATION OF ALPHA-OLEFINS AND METHOD FOR PREPARING SOLID CATALYTIC COMPLEXES FOR USE IN THIS POLYMERISATION PROCESS SOLVAY & Cie (Société Anonyme) (BE) 1981-05-20 EP disclosed
US-4258159-A USING COORDINATION CATALYST SOLVAY & CIE (BE) 1981-03-24 US disclosed
US-4192772-A FOR ALPHA-OLEFIN POLYMERIZATION, COMPLEX OF ALUMINUM, ZIRCONIUM, TITANIUM AND MAGNESIUM COMPOUNDS SOLVAY & CIE (BE) 1980-03-11 US disclosed
US-4187315-A N-alkyl(and cycloalkyl)oxamic acid and derivatives as inhibitors of glycolic acid oxidase MERCK & CO., INC. (US) 1980-02-05 US disclosed
EP-0000007-A1 Process for the polymerisation of alpha-olefins and method for preparing solid catalytic complexes for use in this polymerisation process SOLVAY & Cie (Société Anonyme) (BE) 1978-12-20 EP disclosed
US-4109071-A COMPLEX ORGANO-METALLIC SOLID CATALYST CONTAINING MAGNESIUM, TITANIUM, ZIRCONIUM AND ALUMINUM SOLVAY & CIE. (BE) 1978-08-22 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-20160151387-A1 COMPOSITIONS HAVING C-17 AND C-3 MODIFIED TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY CYP51A1, UGT2B17, HSD17B7 NPC1 1181/4885SMN1; SMN2 4441/4885RAB9A 2014/4885
US-20140343000-A1 COMPOSITIONS HAVING C-17 AND C-3 MODIFIED TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY CYP51A1, UGT2B17, HSD17B7 NPC1 1181/4885SMN1; SMN2 4441/4885RAB9A 2014/4885

“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.