SCHEMBL3083438

SCHEMBL3083438

CC(C)NCCCCCN

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.43
CA2 P00918 4/20 0.43
CA4 P22748 4/20 0.43
CA6 P23280 4/20 0.43
CA5A P35218 4/20 0.43
CA7 P43166 4/20 0.43
CA9 Q16790 4/20 0.43
CA14 Q9ULX7 4/20 0.43
CA5B Q9Y2D0 4/20 0.43
CA1 P00915 3/20 0.43
CA3 P07451 3/20 0.43
TSHR P16473 3/20 0.43
F13A1 P00488 2/20 0.43
CYP1A2 P05177 2/20 0.43
ALOX15 P16050 2/20 0.43
THPO P40225 2/20 0.43
CYP2C9 P11712 1/20 0.43
PKM P14618 1/20 0.43
MTOR P42345 1/20 0.43
PAOX Q6QHF9 2/20 0.43

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
SCHEMBL21800017 1.00 CA12 (0.43) CA12CA2CA4CA6CA5A
SCHEMBL21799799 1.00 CA12 (0.43) CA12CA2CA4CA6CA5A
SCHEMBL18888406 1.00 CA12 (0.43) CA12CA2CA4CA6CA5A
SCHEMBL11805457 1.00 CA12 (0.43) CA12CA2CA4CA6CA5A
SCHEMBL20968106 1.00 CA12 (0.43) CA12CA2CA4CA6CA5A
SCHEMBL20968105 1.00 CA12 (0.43) CA12CA2CA4CA6CA5A
SCHEMBL20968107 1.00 CA12 (0.43) CA12CA2CA4CA6CA5A
SCHEMBL995551 0.97
SCHEMBL19086825 0.93 CA12 (0.56) CA12CA2CA4CA6CA5A
SCHEMBL364371 0.89

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118085273-A Polyamide resin and preparation method and application thereof 华峰集团有限公司 2024-05-28 CN claimed
CN-119301194-A Hydrophilic composition 信越化学工业株式会社 2025-01-10 CN disclosed
EP-3623398-B1 RESIN COMPOSITION COMPRISING A MODIFIED BLOCK COPOLYMER AND METHOD FOR PRODUCING MODIFIED BLOCK COPOLYMER ASAHI CHEMICAL IND (JP) 2024-08-28 EP disclosed
CN-118085273-A Polyamide resin and preparation method and application thereof 华峰集团有限公司 2024-05-28 CN disclosed
CN-117794960-A Hydrophilic copolymers and hydrophilic compositions 信越化学工业株式会社 2024-03-29 CN disclosed
CN-114437342-B Preparation method of high-viscosity polyamide resin 华峰集团有限公司 2023-09-19 CN disclosed
US-11696953-B2 Poly(beta-amino esters) and uses thereof MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2023-07-11 US disclosed
US-11696953-B2 Poly(beta-amino esters) and uses thereof MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2023-07-11 US disclosed
US-11697693-B2 Nitric oxide-releasing alginates as biodegradable antibacterial scaffolds and methods pertaining thereto THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2023-07-11 US disclosed
US-11672818-B2 Nitric oxide-releasing cyclodextrins as biodegradable antibacterial scaffolds and methods pertaining thereto THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2023-06-13 US disclosed
US-7301037-B2 Charged compounds comprising a nucleic acid binding moiety and uses therefor GENESOFT, INC. (US) 2007-11-27 US disclosed
US-20070105135-A1 Charged compounds comprising a nucleic acid binding moiety and uses therefor GENESOFT PHARMACEUTICALS, INC. (US) 2007-05-10 US disclosed
EP-1084114-B1 ISOTHIAZOLE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER PROD INC (US) 2004-09-08 EP disclosed
US-20030149048-A1 Isothiazole derivatives useful as anticancer agents PFIZER INC. 2003-08-07 US disclosed
US-6548526-B2 Isothiazole derivatives useful as anticancer agents PFIZER INC 2003-04-15 US disclosed
US-20010020034-A1 Isothiazole derivatives useful as anticancer agents PFIZER, INC. 2001-09-06 US disclosed
US-6235764-B1 Isothiazole derivatives useful as anticancer agents PFIZER INC. 2001-05-22 US disclosed
EP-1084114-A1 ISOTHIAZOLE DERIVATIVES USEFUL AS ANTICANCER AGENTS Pfizer Products Inc. (US) 2001-03-21 EP disclosed
WO-1999062890-A1 ISOTHIAZOLE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER PRODUCTS INC. (US) 1999-12-09 WO disclosed
EP-0029974-A1 Sulphone amides, their preparation and their use as antimicrobial substances Henkel Kommanditgesellschaft auf Aktien (DE) 1981-06-10 EP 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 (6 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-20010020034-A1 Isothiazole derivatives useful as anticancer agents TP53, MCL1, ACIN1 CA12 4414/4885CA2 2072/4885CA4 2645/4885
US-20070105135-A1 Charged compounds comprising a nucleic acid binding moiety and uses therefor POLRMT, PCNA, SARS1 CA12 3501/4885CA2 1453/4885CA4 3272/4885
US-20030149048-A1 Isothiazole derivatives useful as anticancer agents TP53, MCL1, ACIN1 CA12 4414/4885CA2 2072/4885CA4 2645/4885
US-11672818-B2 Nitric oxide-releasing cyclodextrins as biodegradable antibacterial scaffolds and methods pertaining thereto NOS1, NOS2, NOS3 CA12 3440/4885CA2 942/4885CA4 1590/4885
US-11697693-B2 Nitric oxide-releasing alginates as biodegradable antibacterial scaffolds and methods pertaining thereto NOS1, NOS2, NOS3 CA12 4376/4885CA2 654/4885CA4 3065/4885
US-11696953-B2 Poly(beta-amino esters) and uses thereof BCAT1, BCAT2, SNRPE CA12 2268/4885CA2 3551/4885CA4 2142/4885

“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.