SCHEMBL2467522

SCHEMBL2467522

O=C(O)c1ccc(COCCCCl)cc1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.54
NR4A2 P43354 4/20 0.53
RXRA P19793 7/20 0.50
RXRB P28702 6/20 0.50
HPGD P15428 2/20 0.50
PLA2G4B P0C869 1/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
POLB P06746 1/20 0.49
NR4A1 P22736 1/20 0.49
NR4A3 Q92570 1/20 0.49
RXRG P48443 2/20 0.48
MRGPRX4 Q96LA9 1/20 0.48

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
SCHEMBL27698928 0.93 PLA2G4B (0.53) ALDH1A1NR4A2RXRARXRBHPGD
SCHEMBL27754204 0.85 RARB (0.47) ALDH1A1NR4A2RXRARXRBHPGD
SCHEMBL27613996 0.84 NR4A2 (0.59) ALDH1A1NR4A2RXRARXRBHPGD
SCHEMBL1750568 0.83 PLA2G4B (0.63) ALDH1A1RXRARXRBPLA2G4BNPC1
SCHEMBL25960462 0.83 ALDH1A1 (0.54) ALDH1A1NR4A2RXRARXRBHPGD
SCHEMBL27595132 0.83 ALDH1A1 (0.54) ALDH1A1NR4A2RXRARXRBHPGD
SCHEMBL27719363 0.83 ALDH1A1 (0.54) ALDH1A1NR4A2RXRARXRBHPGD
SCHEMBL27698909 0.83 ALDH1A1 (0.58) ALDH1A1NR4A2RXRARXRBHPGD
SCHEMBL1749669 0.81 PLA2G4B (0.65) ALDH1A1PLA2G4B
SCHEMBL28317367 0.81 ALDH1A1 (0.53) ALDH1A1NR4A2RXRARXRBPLA2G4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2371808-A1 Process for preparing dronedarone Ratiopharm GmbH (DE) 2011-10-05 EP disclosed
US-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 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-20090233910-A1 Npy antagonists, preparation and uses NPY1R, NPY5R, NPY2R ALDH1A1 4542/4885NR4A2 532/4885RXRA 735/4885

“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.