SCHEMBL1933452

SCHEMBL1933452

CC(C)(C)OC(=O)NC=CCN

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CTSK P43235 5/20 0.39
TDP1 Q9NUW8 1/20 0.37
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA7 P43166 2/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35
KMT2A Q03164 1/20 0.35
MAPK10 P53779 1/20 0.35
CA12 O43570 2/20 0.34
CA14 Q9ULX7 2/20 0.34
APLNR P35414 1/20 0.34
RAB9A P51151 1/20 0.33
CYP2D6 P10635 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
SCHEMBL571467 0.82 CTSK (0.40) CTSKTDP1CA1CA2CA7
SCHEMBL20159624 0.82 CTSK (0.40) CTSKTDP1CA1CA2CA7
SCHEMBL16061377 0.82 CTSK (0.40) CTSKTDP1CA1CA2CA7
SCHEMBL2902461 0.82 CTSK (0.36) CTSKTDP1CA1CA2CA7
SCHEMBL15096829 0.81 MAPK10 (0.41) CTSKTDP1CA1CA2CA7
SCHEMBL12571335 0.81 MAPK10 (0.41) CTSKTDP1CA1CA2CA7
SCHEMBL2877516 0.81 CTSK (0.39) CTSKTDP1CA1CA2CA7
SCHEMBL10435327 0.80 TDP1 (0.39) CTSKTDP1CA1CA2CA7
SCHEMBL10776406 0.79 CA1 (0.40) CTSKTDP1CA1CA2CA7
SCHEMBL10100401 0.79 CA1 (0.40) CTSKTDP1CA1CA2CA7

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
CN-118005556-A COX-2 targeted inhibition photosensitizer capable of activating tumor cell apoptosis and preparation method and application thereof 大连理工大学 2024-05-10 CN claimed
CN-117384642-A Selective etching solution 湖北兴福电子材料股份有限公司 2024-01-12 CN claimed
CN-116354901-A Thiazolidinedione compound and preparation method and application thereof 郑州大学 2023-06-30 CN claimed
CN-118005556-A COX-2 targeted inhibition photosensitizer capable of activating tumor cell apoptosis and preparation method and application thereof 大连理工大学 2024-05-10 CN disclosed
CN-116354901-B Thiazolidinedione compound and preparation method and application thereof 郑州大学 2024-04-26 CN disclosed
CN-117088864-A Benzo [ d ] isoxazole compound and application thereof 广州智药生物科技有限公司 2023-11-21 CN disclosed
CN-116354901-A Thiazolidinedione compound and preparation method and application thereof 郑州大学 2023-06-30 CN disclosed
CN-110291849-B Wiring forming method 日产化学株式会社 2023-06-06 CN disclosed
US-10597491-B2 Metal fine particle dispersant containing branched polymer compound having ammonium group NISSAN CHEMICAL CORPORATION (JP) 2020-03-24 US disclosed
EP-3190207-B1 PHOTOCURABLE ELECTROLESS PLATING PRIMER NISSAN CHEMICAL CORP (JP) 2019-05-08 EP disclosed
US-9893366-B2 Metal fine particle association and method for producing the same NATIONAL UNIVERSITY CORPORATION GUNMA UNIVERSITY (JP) 2018-02-13 US disclosed
EP-2698448-A1 ELECTROLESS PLATING PRIMER INCLUDING HYPERBRANCHED POLYMER AND METALLIC MICROPARTICLES Nissan Chemical Industries, Ltd. (JP) 2014-02-19 EP disclosed
US-8338554-B2 Hyperbranched polymer and method for producing the same NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2012-12-25 US disclosed
US-20110183837-A1 METAL FINE PARTICLE DISPERSANT CONTAINING BRANCHED POLYMER COMPOUND HAVING AMMONIUM GROUP NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2011-07-28 US disclosed
EP-2332640-A1 METAL MICROPARTICLE-DISPERSING AGENT COMPRISING BRANCHED POLYMERIC COMPOUND HAVING AMMONIUM GROUP Nissan Chemical Industries, Ltd. (JP) 2011-06-15 EP disclosed
US-20100048845-A1 Hyperbranched polymer and method for producing the same NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2010-02-25 US disclosed
EP-2058338-A1 HYPERBRANCHED POLYMER AND METHOD FOR PRODUCING THE SAME Nissan Chemical Industries, Ltd. (JP) 2009-05-13 EP disclosed
US-7094789-B2 5-substituted isoquinoline derivatives ASAHI KASEI PHARMA CORPORATION (JP) 2006-08-22 US disclosed
EP-1541559-A1 5-SUBSTITUTED ISOQUINOLINE DERIVATIVE Asahi Kasei Pharma Corporation (JP) 2005-06-15 EP disclosed
US-20050020623-A1 5-Substituted isoquinoline derivatives ASAHI KASEI PHARMA CORPORATION (JP) 2005-01-27 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 (1 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-20050020623-A1 5-Substituted isoquinoline derivatives MYLK, MYLK2, MYL12A CTSK 4434/4885TDP1 2039/4885CA1 3439/4885

“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.