SCHEMBL829279

SCHEMBL829279

CCN(c1ccc(C(=O)O)cc1)c1cc2c3c(c1)CCCC3(C)CCC2

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RXRA P19793 16/20 0.56
RXRB P28702 15/20 0.56
RXRG P48443 15/20 0.56
KDM4C Q9H3R0 1/20 0.38
ALDH1A1 P00352 1/20 0.36
KDM1A O60341 1/20 0.36
RARA P10276 1/20 0.35
RARB P10826 1/20 0.35
RARG P13631 1/20 0.35

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
SCHEMBL830065 0.86 RXRA (0.44) RXRARXRBRXRGKDM4CKDM1A
SCHEMBL830447 0.86 RXRA (0.41) RXRARXRBRXRGALDH1A1RARA
SCHEMBL830263 0.84 RXRA (0.47) RXRARXRBRXRGALDH1A1KDM1A
SCHEMBL829946 0.82 RXRA (0.56) RXRARXRBRXRGKDM4CALDH1A1
SCHEMBL829859 0.79 RXRA (0.48) RXRARXRBRXRGKDM4CALDH1A1
SCHEMBL830495 0.78 RXRB (0.47) RXRARXRBRXRGKDM4CALDH1A1
SCHEMBL829839 0.77 ALDH1A1 (0.46) RXRARXRBRXRGALDH1A1KDM1A
SCHEMBL11570366 0.75 RXRA (0.62) RXRARXRBRXRGALDH1A1
SCHEMBL829589 0.74 RXRA (0.43) RXRARXRBRXRGALDH1A1KDM1A
SCHEMBL11955422 0.73 MEN1 (0.55) RXRARXRBRXRGALDH1A1RARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8143260-B2 Tricyclic amine compound RESEARCH FOUNDATION ITSUU LABORATORY (JP) 2012-03-27 US disclosed
US-8143260-B2 Tricyclic amine compound RESEARCH FOUNDATION ITSUU LABORATORY (JP) 2012-03-27 US disclosed
US-8143260-B2 Tricyclic amine compound RESEARCH FOUNDATION ITSUU LABORATORY (JP) 2012-03-27 US disclosed
US-20110288299-A1 TRICYCLIC AMINE COMPOUND RESEARCH FOUNDATION ITSUU LABORATORY (JP) 2011-11-24 US disclosed
US-20110288299-A1 TRICYCLIC AMINE COMPOUND RESEARCH FOUNDATION ITSUU LABORATORY (JP) 2011-11-24 US disclosed
US-20110288299-A1 TRICYCLIC AMINE COMPOUND RESEARCH FOUNDATION ITSUU LABORATORY (JP) 2011-11-24 US disclosed
EP-2189440-A1 TRICYCLIC AMINE COMPOUND Research Foundation Itsuu Laboratory (JP) 2010-05-26 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-20110288299-A1 TRICYCLIC AMINE COMPOUND RXRA, RXRB, NR2C2 RXRA 1/4885RXRB 2/4885RXRG 4/4885

“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.