SCHEMBL675922

SCHEMBL675922

O=CC1CCC(=O)NC1=O

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 19/20 0.43
DDB1 Q16531 16/20 0.43
ALDH1A1 P00352 1/20 0.38
CHRM2 P08172 1/20 0.38
OPRM1 P35372 1/20 0.38
IKZF3 Q9UKT9 1/20 0.38
CYP1A2 P05177 1/20 0.38
TSHR P16473 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
TNF P01375 1/20 0.37

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
SCHEMBL24530802 0.80 CRBN (0.40) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL13678434 0.80 CRBN (0.40) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL12396073 0.76
SCHEMBL17884541 0.68 CRBN (0.50) CRBNDDB1IKZF3
SCHEMBL3628061 0.67
SCHEMBL19370773 0.67
SCHEMBL493044 0.67
SCHEMBL22166575 0.67
SCHEMBL528253 0.67
SCHEMBL8030518 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8957056-B2 Migrastatin analogs in the treatment of cancer SLOAN-KETTERING INSTIUTE FOR CANCER RESEARCH (US) 2015-02-17 US disclosed
US-8835693-B2 Migrastatin analogs and uses thereof SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2014-09-16 US disclosed
EP-1805161-B1 ISOMIGRASTATIN ANALOGS IN THE TREATMENT OF CANCER SLOAN KETTERING INST CANCER (US) 2014-05-07 EP disclosed
US-20140011844-A1 MIGRASTATIN ANALOGS AND USES THEREOF SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2014-01-09 US disclosed
US-8324284-B2 Migrastatin analogs and uses thereof SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2012-12-04 US disclosed
US-8202911-B2 Migrastatin analog compositions and uses thereof CORNELL RESEARCH FOUNDATION, INC. (US) 2012-06-19 US disclosed
US-8188141-B2 Isomigrastatin analogs in the treatment of cancer SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2012-05-29 US disclosed
US-20110281916-A1 MIGRASTATIN ANALOGS AND USES THEREOF SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2011-11-17 US disclosed
US-20110263653-A1 MIGRASTATIN ANALOG COMPOSITIONS AND USES THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2011-10-27 US disclosed
US-7943800-B2 Migrastatin analogs and uses thereof SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2011-05-17 US disclosed
US-20090054488-A1 Isomigrastatin Analogs In The Treatment Of Cancer NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2009-02-26 US disclosed
EP-1805161-A2 ISOMIGRASTATIN ANALOGS IN THE TREATMENT OF CANCER Sloan-Kettering Institute For Cancer Research (US) 2007-07-11 EP disclosed
US-20070037852-A1 Migrastatin analogs and uses thereof NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2007-02-15 US disclosed
US-20070037783-A1 Migrastatin analogs and uses thereof NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2007-02-15 US disclosed
WO-2006034478-A2 ISOMIGRASTATIN ANALOGS IN THE TREATMENT OF CANCER SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2006-03-30 WO disclosed
EP-1613603-A2 MIGRASTATIN ANALOGS AND USES THEREOF Sloan-Kettering Institute For Cancer Research (US) 2006-01-11 EP disclosed
WO-2006001967-A2 MIGRASTATIN ANALOGS IN THE TREATMENT OF CANCER SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2006-01-05 WO disclosed
EP-1608626-A1 MIGRASTATIN ANALOG COMPOSITIONS AND USES THEREOF CORNELL RESEARCH FOUNDATION, INC. (US) 2005-12-28 EP disclosed
WO-2004087672-A1 MIGRASTATIN ANALOG COMPOSITIONS AND USES THEREOF CORNELL RESEARCH FOUNDATION, INC. (US) 2004-10-14 WO disclosed
WO-2004087673-A2 MIGRASTATIN ANALOGS AND USES THEREOF SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2004-10-14 WO 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-20070037783-A1 Migrastatin analogs and uses thereof FOXM1, MTX1, C3AR1 CRBN 3154/4885DDB1 4771/4885ALDH1A1 1571/4885
US-20090054488-A1 Isomigrastatin Analogs In The Treatment Of Cancer EDNRB, KDR, IGF1R CRBN 2678/4885DDB1 3573/4885ALDH1A1 1703/4885
US-20110281916-A1 MIGRASTATIN ANALOGS AND USES THEREOF KDR, HMGCR, LPAR3 CRBN 2072/4885DDB1 4207/4885ALDH1A1 1123/4885
US-20110263653-A1 MIGRASTATIN ANALOG COMPOSITIONS AND USES THEREOF C3AR1, C1R, MRPS18A CRBN 2992/4885DDB1 4746/4885ALDH1A1 1845/4885
US-20070037852-A1 Migrastatin analogs and uses thereof KDR, MTX1, FOXM1 CRBN 2312/4885DDB1 4193/4885ALDH1A1 1124/4885
US-20140011844-A1 MIGRASTATIN ANALOGS AND USES THEREOF KDR, HMGCR, LPAR3 CRBN 2072/4885DDB1 4207/4885ALDH1A1 1123/4885

“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.