SCHEMBL629167

SCHEMBL629167

O=C(O)Cc1coc(-c2cc(F)cc(C(F)(F)F)c2)n1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RXRA P19793 4/20 0.53
RXRB P28702 4/20 0.53
RXRG P48443 4/20 0.53
LMNA P02545 1/20 0.44
PPARG P37231 2/20 0.42
PPARA Q07869 2/20 0.42
GAA P10253 1/20 0.42
TSHR P16473 1/20 0.42
KMT2A Q03164 1/20 0.42
FFAR1 O14842 1/20 0.40
HPGD P15428 1/20 0.40
KDM4E B2RXH2 1/20 0.37
SMN1; SMN2 Q16637 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
SCHEMBL628795 0.92 RXRA (0.49) RXRARXRBRXRGLMNAPPARG
SCHEMBL629104 0.86 S1PR1 (0.43) RXRARXRBRXRGLMNAPPARG
SCHEMBL27767986 0.84 PPARG (0.48) RXRARXRBRXRGLMNAPPARG
SCHEMBL629626 0.83 RXRA (0.57) RXRARXRBRXRGLMNAPPARG
SCHEMBL10029574 0.82 LMNA (0.46) LMNAGAATSHRKMT2AFFAR1
SCHEMBL2108560 0.81 PTPN11 (0.41) RXRARXRBRXRGLMNAPPARG
SCHEMBL2108233 0.80 CTSK (0.40) RXRARXRBRXRGLMNAPPARG
SCHEMBL628808 0.79 LMNA (0.41) RXRARXRBRXRGLMNAPPARG
SCHEMBL2108474 0.77 PPARG (0.40) RXRARXRBRXRGPPARGPPARA
SCHEMBL2108513 0.77 PPARG (0.46) RXRARXRBRXRGLMNAPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120077854-A1 COMPOSITIONS AND METHODS FOR MODULATING RETINOL BINDING TO RETINOL BINDING PROTEIN 4 (RBP4) IRM LLC (BM) 2012-03-29 US disclosed
EP-2419412-A1 COMPOSITIONS AND METHODS FOR MODULATING RETINOL BINDING TO RETINOL BINDING PROTEIN 4 (RBP4) IRM LLC (BM) 2012-02-22 EP disclosed
WO-2010120741-A1 COMPOSITIONS AND METHODS FOR MODULATING RETINOL BINDING TO RETINOL BINDING PROTEIN 4 (RBP4) IRM LLC (US) 2010-10-21 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 (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-20120077854-A1 COMPOSITIONS AND METHODS FOR MODULATING RETINOL BINDING TO RETINOL BINDING PROTEIN 4 (RBP4) RBP4, RBP1, FABP4 RXRA 11/4885RXRB 5/4885RXRG 10/4885

“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.