SCHEMBL628001

SCHEMBL628001

O=C(O)Cc1coc(-c2ccc(F)c(C(F)(F)F)c2)n1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.46
KMO O15229 2/20 0.45
MPL P40238 1/20 0.45
GAA P10253 1/20 0.44
TSHR P16473 1/20 0.44
KMT2A Q03164 1/20 0.44
RXRA P19793 3/20 0.43
RXRB P28702 3/20 0.43
RXRG P48443 3/20 0.43
HPGD P15428 1/20 0.41
PPARG P37231 2/20 0.40
PPARA Q07869 2/20 0.40

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
SCHEMBL13148639 0.88 MPL (0.41) LMNAKMOMPLGAATSHR
SCHEMBL628808 0.85 LMNA (0.41) LMNAGAATSHRKMT2ARXRA
SCHEMBL627996 0.83 S1PR1 (0.50) LMNAGAARXRARXRBRXRG
SCHEMBL10029579 0.82 LMNA (0.48) LMNAGAATSHRKMT2AHPGD
SCHEMBL4872369 0.81 KMO (0.55) KMOMPL
SCHEMBL628795 0.78 RXRA (0.49) LMNAGAATSHRKMT2ARXRA
SCHEMBL629167 0.76 RXRA (0.53) LMNAGAATSHRKMT2ARXRA
SCHEMBL629896 0.76 LMNA (0.65) LMNAKMOMPLGAARXRA
SCHEMBL629104 0.75 S1PR1 (0.43) LMNAGAATSHRKMT2ARXRA
SCHEMBL5117052 0.75 HDAC1 (0.56) LMNAGAATSHRKMT2A

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 4 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
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 LMNA 1913/4885KMO 4552/4885MPL 4805/4885

“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.