SCHEMBL1070085

SCHEMBL1070085

NNC(=O)[C@@H](N)Cc1c[nH]cn1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CSK P41240 1/20 0.33
CYP3A4 P08684 1/20 0.31
SLC7A5 Q01650 1/20 0.31
NLN Q9BYT8 1/20 0.31
P2RX7 Q99572 1/20 0.31
CYP1A2 P05177 1/20 0.30

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
SCHEMBL1070087 1.00 CSK (0.33) CSKCYP3A4SLC7A5NLNP2RX7
SCHEMBL3268628 0.87 OPRD1 (0.33)
SCHEMBL4197031 0.87 CSK (0.45) CSKCYP3A4SLC7A5NLNCYP1A2
SCHEMBL11620101 0.87 CSK (0.45) CSKCYP3A4SLC7A5NLNCYP1A2
SCHEMBL30745117 0.86 CSK (0.32) CSKCYP3A4SLC7A5NLN
SCHEMBL14151247 0.86 NLN (0.39) NLN
SCHEMBL3835499 0.86 LTA4H (0.33) CSKCYP3A4SLC7A5NLN
SCHEMBL6957264 0.86 CSK (0.32) CSKCYP3A4SLC7A5NLN
SCHEMBL3835494 0.86 LTA4H (0.33) CSKCYP3A4SLC7A5NLN
SCHEMBL27913327 0.84 CYP3A4 (0.33) CSKCYP3A4SLC7A5NLNCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118184926-A Amino acid functionalized chiral covalent organic framework material and preparation and application thereof 周口师范学院 2024-06-14 CN claimed
US-4138292-A ENZYMES OR MICROORGANISMS IN A SULFATED POLYSACCHARIDE GEL TANABE SEIYAKU CO., LTD. (JP) 1979-02-06 US claimed
CN-118184926-A Amino acid functionalized chiral covalent organic framework material and preparation and application thereof 周口师范学院 2024-06-14 CN disclosed
US-8198323-B2 Curcumin analogues and uses thereof THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2012-06-12 US disclosed
EP-1855544-B1 GELATION OF ANIONIC POLYSACCARIDES USING PROTEIN HYDROLYSATES UNILEVER NV (NL) 2011-01-19 EP disclosed
US-20100197784-A1 NOVEL CURCUMIN ANALOGUES AND USES THEREOF The University of North Carlina at Chapel Hill (US) 2010-08-05 US disclosed
EP-1494993-B1 NOVEL CURCUMIN ANALOGUES AND USES THEREOF UNIV NORTH CAROLINA (US) 2010-05-05 EP disclosed
US-7709535-B2 Curcumin analogues and uses thereof THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2010-05-04 US disclosed
US-20080161391-A1 NOVEL CURCUMIN ANALOGUES AND USES THEREOF THE UNIVERSITY OF NORTH CAROLINA (US) 2008-07-03 US disclosed
US-20080146660-A1 NOVEL CURCUMIN ANALOGUES AND USES THEREOF THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2008-06-19 US disclosed
US-7355081-B2 androgen receptor antagonists; certain cancers, baldness, hirsutism, behavioral disorders, acne, and inhibition of spermatogenesis if so desired THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2008-04-08 US disclosed
EP-1494993-A4 NOVEL CURCUMIN ANALOGUES AND USES THEREOF UNIV NORTH CAROLINA (US) 2005-09-14 EP disclosed
US-20050187255-A1 Novel curcumin analogues and uses thereof UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL 2005-08-25 US disclosed
EP-1494993-A2 NOVEL CURCUMIN ANALOGUES AND USES THEREOF UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2005-01-12 EP disclosed
US-6790979-B2 USE AS ANTITUMOR AGENTS, PARTICULARLY FOR THE TREATMENT OF CANCERS SUCH AS COLON, SKIN AND PROSTATE CANCER AND TO INDUCE ANDROGEN RECEPTOR ANTAGONIST ACTIVITY IN SUBJECT WITH ANDROGEN-RELATED AFFLICTION UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL 2004-09-14 US disclosed
WO-2003088927-A2 NOVEL CURCUMIN ANALOGUES AND USES THEREOF UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2003-10-30 WO disclosed
US-20030203933-A1 Novel curcumin analogues and uses thereof NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2003-10-30 US disclosed
EP-0228192-A2 Renin-inhibitory oligopeptides, their preparation and use SANKYO COMPANY LIMITED (JP) 1987-07-08 EP disclosed
EP-0123444-A1 4-Substituted-2-azetidinone compound, process of producing the compounds, and medicaments containing the compounds YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1984-10-31 EP disclosed
US-4138292-A ENZYMES OR MICROORGANISMS IN A SULFATED POLYSACCHARIDE GEL TANABE SEIYAKU CO., LTD. (JP) 1979-02-06 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 (5 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-20080146660-A1 NOVEL CURCUMIN ANALOGUES AND USES THEREOF AR, NR5A1, BRDT CSK 4018/4885CYP3A4 1295/4885SLC7A5 4495/4885
US-20050187255-A1 Novel curcumin analogues and uses thereof AR, NR5A1, BRDT CSK 4018/4885CYP3A4 1295/4885SLC7A5 4495/4885
US-20080161391-A1 NOVEL CURCUMIN ANALOGUES AND USES THEREOF AR, NR5A1, BRDT CSK 4018/4885CYP3A4 1295/4885SLC7A5 4495/4885
US-20030203933-A1 Novel curcumin analogues and uses thereof AR, NR5A1, BRDT CSK 4018/4885CYP3A4 1295/4885SLC7A5 4495/4885
US-20100197784-A1 NOVEL CURCUMIN ANALOGUES AND USES THEREOF AR, NR5A1, BRDT CSK 4018/4885CYP3A4 1295/4885SLC7A5 4495/4885

“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.