SCHEMBL14214331

SCHEMBL14214331

Cc1ccc(Cn2c(-c3ccc(Oc4cccc(NC(=O)OCCCN5CCOCC5)c4)cc3)cc(C(F)(F)F)c(C#N)c2=O)c(C)c1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.48
NR1H2 P55055 1/20 0.48
NR1H3 Q13133 1/20 0.48
EPHX2 P34913 11/20 0.42
TRPV4 Q9HBA0 5/20 0.40
MET P08581 1/20 0.39
RAF1 P04049 1/20 0.39
MAP2K1 Q02750 1/20 0.39

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
SCHEMBL14184076 0.94 RXRA (0.46) RXRANR1H2NR1H3EPHX2TRPV4
SCHEMBL14214307 0.94 RXRA (0.49) RXRANR1H2NR1H3TRPV4RAF1
SCHEMBL14184077 0.87 RXRA (0.46) RXRANR1H2NR1H3EPHX2TRPV4
SCHEMBL14214374 0.85 EPHX2 (0.41) EPHX2TRPV4RAF1
SCHEMBL4905566 0.85 RXRA (0.62) RXRANR1H2NR1H3
SCHEMBL14214279 0.84 RXRA (0.56) RXRANR1H2NR1H3
SCHEMBL4899595 0.84 RXRA (0.42) RXRANR1H2NR1H3
Hydrochloric Acid SCHEMBL4904474 0.83 RXRA (0.42) RXRANR1H2NR1H3
SCHEMBL14184083 0.82 RXRA (0.49) RXRANR1H2NR1H3MET
SCHEMBL14184079 0.81 RXRA (0.48) RXRANR1H2NR1H3MET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080119488-A1 Modulators Of Nuclear Receptors EXELIXIS, INC. (US) 2008-05-22 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 (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-20080119488-A1 Modulators Of Nuclear Receptors NR1H2, NR0B1, NR1H3 RXRA 20/4885NR1H2 1/4885NR1H3 3/4885

“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.