SCHEMBL1401938

SCHEMBL1401938

CC(C)CCC1=C(C(C)C)CCCC1=O

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RXRA P19793 8/20 0.44
IDO1 P14902 1/20 0.35
DHODH Q02127 1/20 0.33
DAO P14920 1/20 0.33
SORT1 Q99523 1/20 0.33

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
SCHEMBL1401945 0.78 RXRA (0.43) RXRAIDO1DHODHDAOSORT1
SCHEMBL1401939 0.74 RXRA (0.46) RXRAIDO1DHODHDAOSORT1
SCHEMBL1401932 0.74 RXRA (0.50) RXRAIDO1DHODH
SCHEMBL1401935 0.73 ALDH1A1 (0.36) IDO1DHODH
SCHEMBL13562166 0.67 TP53 (0.32)
SCHEMBL14220940 0.66
SCHEMBL18198947 0.66 TP53 (0.31)
SCHEMBL1524885 0.64
SCHEMBL21633992 0.63 GSTP1 (0.46) DHODHDAOSORT1
SCHEMBL1078427 0.62 DAO (0.38) IDO1DHODHDAOSORT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160106697-A1 METHODS FOR MAKING RETINOIDS AND USES THEREOF THE UAB RESEARCH FOUNDATION (US) 2016-04-21 US disclosed
US-9169190-B2 Methods for making retinoids and uses thereof THE UAB RESEARCH FOUNDATION (US) 2015-10-27 US disclosed
EP-2292576-B1 Retinoids useful in the treatment of cancer and for reducing serum triglycerides UAB RESEARCH FOUNDATION (US) 2014-05-07 EP disclosed
US-20130317106-A1 METHODS FOR MAKING RETINOIDS AND USES THEREOF THE UAB RESEARCH FOUNDATION (US) 2013-11-28 US disclosed
EP-2292576-A2 Retinoids useful in the treatment of cancer and for reducing serum triglycerides The UAB Research Foundation (US) 2011-03-09 EP disclosed
US-20100204327-A1 Methods for making retinoids and uses thereof NATIONAL INSTITUTES OF HEALTH-DIRECTOR DEITR 2010-08-12 US disclosed
EP-1791426-A2 METHODS FOR MAKING RETINOIDS AND USES THEREOF THE UAB RESEARCH FOUNDATION (US) 2007-06-06 EP disclosed
WO-2006036394-A2 METHODS FOR MAKING RETINOIDS AND USES THEREOF THE UAB RESEARCH FOUNDATION (US) 2006-04-06 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 (3 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-20130317106-A1 METHODS FOR MAKING RETINOIDS AND USES THEREOF RARB, RARA, RARG RXRA 5/4885IDO1 4761/4885DHODH 310/4885
US-20100204327-A1 Methods for making retinoids and uses thereof RARB, RARA, RARG RXRA 5/4885IDO1 4761/4885DHODH 310/4885
US-20160106697-A1 METHODS FOR MAKING RETINOIDS AND USES THEREOF RARB, RARA, RARG RXRA 5/4885IDO1 4761/4885DHODH 310/4885

“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.