SCHEMBL416386

SCHEMBL416386

OC(C#CC#CC(O)(c1ccc(-c2ccccc2)cc1)c1ccc(-c2ccccc2)cc1)(c1ccc(-c2ccccc2)cc1)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.50
KIF11 P52732 1/20 0.46
PTPN5 P54829 1/20 0.42
MMP3 P08254 1/20 0.41
BCL2L1 Q07817 1/20 0.41
ALDH1A1 P00352 3/20 0.41
KMT2A Q03164 1/20 0.40
KDM4E B2RXH2 1/20 0.38
PABPC1 P11940 1/20 0.38
APOBEC3A P31941 1/20 0.38
APOBEC3G Q9HC16 1/20 0.38
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
MGLL Q99685 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
CTDSP1 Q9GZU7 1/20 0.36

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
SCHEMBL414397 0.86 ALDH1A1 (0.50) CYP2C9ALDH1A1KMT2AKDM4EPABPC1
SCHEMBL7729779 0.78 CYP2C9 (0.50) CYP2C9KIF11PTPN5MMP3BCL2L1
SCHEMBL7734271 0.77 CYP2C9 (0.48) CYP2C9KIF11PTPN5MMP3BCL2L1
SCHEMBL1758086 0.76 ALDH1A1 (0.53) CYP2C9ALDH1A1KMT2AKDM4EPABPC1
SCHEMBL9626191 0.76 ALDH1A1 (0.46) CYP2C9ALDH1A1KMT2AKDM4EPABPC1
SCHEMBL14076787 0.75 KIF11 (0.47) CYP2C9KIF11ALDH1A1
SCHEMBL410926 0.75 KIF11 (0.45) KIF11ALDH1A1KMT2A
SCHEMBL25489530 0.74 CYP2C9 (0.60) CYP2C9KIF11PTPN5MMP3BCL2L1
SCHEMBL31589360 0.74 CYP2C9 (0.60) CYP2C9KIF11PTPN5MMP3BCL2L1
SCHEMBL4009331 0.74 ALDH1A1 (0.49) CYP2C9ALDH1A1KMT2AKDM4EPABPC1

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2082890-B1 Thermoplastic material comprising polychromic substances DATALASE LTD (GB) 2015-08-19 EP disclosed
US-8663902-B2 Laser imaging DATALASE LTD (GB) 2014-03-04 US disclosed
US-8211620-B2 Thermoplastic material comprising polychromic substances THE PROCTER & GAMBLE COMPANY (US) 2012-07-03 US disclosed
EP-2235591-B1 POLYCHROMIC SUBSTANCES AND THEIR USE DATALASE LTD (GB) 2012-02-22 EP disclosed
US-20120021362-A1 Laser Imaging DATALASE LTD. (GB) 2012-01-26 US disclosed
US-8083973-B2 Polychromic substances and their use DATALASE LTD. (GB) 2011-12-27 US disclosed
US-20110109014-A1 THERMOPLASTIC MATERIAL COMPRISING POLYCHROMIC SUBSTANCES ROGERS NEIL JOHN 2011-05-12 US disclosed
US-7897320-B2 Thermoplastic material comprising polychromic substances THE PROCTER & GAMBLE COMPANY (US) 2011-03-01 US disclosed
US-20110017961-A1 Polychromic Substances and Their Use DATALASE LTD (GB) 2011-01-27 US disclosed
US-20090191480-A1 THERMOPLASTIC MATERIAL COMPRISING POLYCHROMIC SUBSTANCES DATALASE LTD (GB) 2009-07-30 US disclosed
EP-2082890-A1 Thermoplastic material comprising polychromic substances The Procter and Gamble Company (US) 2009-07-29 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 (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-20110017961-A1 Polychromic Substances and Their Use RXRG, RXRA, RXRB CYP2C9 1628/4885KIF11 2551/4885PTPN5 2010/4885

“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.