SCHEMBL6318341

SCHEMBL6318341

O=C=N[C@H]1CC[C@@H](C[C@H]2CC[C@@H](N=C=O)CC2)CC1

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.54
APLNR P35414 1/20 0.36
CYP3A4 P08684 1/20 0.35
KMT2A Q03164 1/20 0.31

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
SCHEMBL22543 1.00 ALDH1A1 (0.54) ALDH1A1APLNRCYP3A4KMT2A
SCHEMBL8733246 1.00 ALDH1A1 (0.54) ALDH1A1APLNRCYP3A4KMT2A
SCHEMBL5902920 1.00 ALDH1A1 (0.54) ALDH1A1APLNRCYP3A4KMT2A
SCHEMBL7192102 1.00 ALDH1A1 (0.54) ALDH1A1APLNRCYP3A4KMT2A
SCHEMBL10507329 1.00 ALDH1A1 (0.54) ALDH1A1APLNRCYP3A4KMT2A
SCHEMBL23743495 1.00 ALDH1A1 (0.54) ALDH1A1APLNRCYP3A4KMT2A
SCHEMBL5903114 1.00 ALDH1A1 (0.54) ALDH1A1APLNRCYP3A4KMT2A
Methane SCHEMBL10803844 0.98 ALDH1A1 (0.52) ALDH1A1APLNRCYP3A4
SCHEMBL4556661 0.93 ALDH1A1 (0.48) ALDH1A1APLNRCYP3A4
SCHEMBL1179083 0.93 ALDH1A1 (0.48) ALDH1A1APLNRCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6887877-B2 Compounds and methods for the treatment or prevention of Flavivirus infections VIROCHEM PHARMA INC. (CA) 2005-05-03 US claimed
US-20030229053-A1 Compounds and methods for the treatment or prevention of flavivirus infections SHIRE BIOCHEM INC. (CA) 2003-12-11 US claimed
US-11904574-B2 Scratch resistant film and surface coating composition 3M INNOVATIVE PROPERTIES COMPANY (US) 2024-02-20 US disclosed
US-11787217-B2 Over-laminate film and graphic laminate 3M INNOVATIVE PROPERTIES COMPANY (US) 2023-10-17 US disclosed
US-20230323144-A1 FILM AND METHOD OF PRODUCING THE SAME 3M INNOVATIVE PROPERTIES COMPANY 2023-10-12 US disclosed
US-20220195216-A1 OVER-LAMINATE FILM AND GRAPHIC LAMINATE 3M INNOVATIVE PROPERTIES COMPANY 2022-06-23 US disclosed
US-20220185007-A1 FILM 3M INNOVATIVE PROPERTIES COMPANY 2022-06-16 US disclosed
WO-2022009022-A1 FILM AND METHOD OF PRODUCING THE SAME 3M INNOVATIVE PROPERTIES COMPANY (US) 2022-01-13 WO disclosed
US-20210395965-A1 Decorative Sheet for Road Surface, Precursor For Graphic Construct, Method of Producing Graphic Construct Sheet, And Method of Installing Decorative Sheet for Road Surface 3M INNOVATIVE PROPERTIES COMPANY 2021-12-23 US disclosed
US-20210061968-A1 SCRATCH RESISTANT FILM AND SURFACE COATING COMPOSITION 3M INNOVATIVE PROPERTIES COMPANY 2021-03-04 US disclosed
US-10774242-B2 Transfer sheet, and decorative film, and method for producing same 3M INNOVATIVE PROPERTIES COMPANY (US) 2020-09-15 US disclosed
US-6939939-B2 Polyurea/urethane optical material and method for making it YOUNGER MFG. (US) 2005-09-06 US disclosed
US-6887877-B2 Compounds and methods for the treatment or prevention of Flavivirus infections VIROCHEM PHARMA INC. (CA) 2005-05-03 US disclosed
WO-2004076518-A1 POLYUREA/URETHANE OPTICAL MATERIAL AND METHOD FOR MAKING IT YOUNGER MFG. CO. DBA YOUNGER OPTICS (US) 2004-09-10 WO disclosed
US-20040167311-A1 Polyurea/urethane optical material and method for making it YOUNGER MFG. CO. DBA YOUNGER OPTICS 2004-08-26 US disclosed
EP-1395571-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OR PREVENTION OF FLAVIVIRUS INFECTIONS Shire Biochem Inc. (CA) 2004-03-10 EP disclosed
US-20030229053-A1 Compounds and methods for the treatment or prevention of flavivirus infections SHIRE BIOCHEM INC. (CA) 2003-12-11 US disclosed
WO-2002100846-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OR PREVENTION OF FLAVIVIRUS INFECTIONS SHIRE BIOCHEM INC. (CA) 2002-12-19 WO disclosed
EP-0421215-A2 Process for the preparation of light and exhaust gas resistant PUH elastomer fibres and films and the elastomer fibres with the corresponding composition BAYER AG (DE) 1991-04-10 EP disclosed
US-4879409-A CYCLOHEXYLMETHANE DIISOCYANATES BAYER AKTIENGESELLSCHAFT (DE) 1989-11-07 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-20030229053-A1 Compounds and methods for the treatment or prevention of flavivirus infections HAVCR2, ZC3HAV1, MAVS ALDH1A1 245/4885APLNR 4324/4885CYP3A4 452/4885

“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.