SCHEMBL1950757

SCHEMBL1950757

CCCCNC(=O)CN(CCc1ccc(Br)cc1)C(=O)OCCCC

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
RAB9A P51151 1/20 0.44
LMNA P02545 1/20 0.42
MGLL Q99685 1/20 0.42
HPGD P15428 2/20 0.41
THRB P10828 1/20 0.41
HTT P42858 1/20 0.41
FSHR P23945 1/20 0.41
KDM4E B2RXH2 1/20 0.41
GLA P06280 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL3670220 0.83 FSHR (0.50) MEN1KMT2ALMNAHPGDFSHR
SCHEMBL1948554 0.78 FSHR (0.48) MEN1KMT2ALMNAHPGDHTT
SCHEMBL8585756 0.73 KMT2A (0.56) MEN1KMT2ARAB9AMGLLGLA
SCHEMBL1949617 0.72 CTSL (0.44) FSHR
SCHEMBL4769268 0.71 HPGD (0.73) MEN1KMT2ARAB9ALMNAHPGD
SCHEMBL16682333 0.70 LMNA (0.50) RAB9ALMNA
SCHEMBL27919371 0.70 DGKA (0.50) MEN1KMT2ALMNAKDM4EL3MBTL1
SCHEMBL5598339 0.69 CHRNB2 (0.47) MEN1KMT2ARAB9AMGLLHPGD
SCHEMBL27411822 0.69 PLAAT3 (0.52) KMT2ALMNAHPGD
SCHEMBL5112506 0.67 TDP1 (0.48) MEN1KMT2ARAB9ALMNAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110136877-A1 2-PHENYL PHENOXYACETIC ACIDS USEFUL FOR TREATING INFLAMMATORY DISORDERS LIGAND PHARMACEUTICALS INC. (US) 2011-06-09 US disclosed
US-20110136877-A1 2-PHENYL PHENOXYACETIC ACIDS USEFUL FOR TREATING INFLAMMATORY DISORDERS LIGAND PHARMACEUTICALS INC. (US) 2011-06-09 US disclosed
US-20110136877-A1 2-PHENYL PHENOXYACETIC ACIDS USEFUL FOR TREATING INFLAMMATORY DISORDERS LIGAND PHARMACEUTICALS INC. (US) 2011-06-09 US disclosed
EP-2240434-A1 2-PHENYL PHENOXYACETIC ACIDS USEFUL FOR TREATING INFLAMMATORY DISORDERS Ligand Pharmaceuticals Inc. (US) 2010-10-20 EP disclosed
WO-2009089192-A1 2-PHENYL PHENOXYACETIC ACIDS USEFUL FOR TREATING INFLAMMATORY DISORDERS LIGAND PHARMACEUTICALS INC. (US) 2009-07-16 WO disclosed
WO-2009089192-A1 2-PHENYL PHENOXYACETIC ACIDS USEFUL FOR TREATING INFLAMMATORY DISORDERS LIGAND PHARMACEUTICALS INC. (US) 2009-07-16 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-20110136877-A1 2-PHENYL PHENOXYACETIC ACIDS USEFUL FOR TREATING INFLAMMATORY DISORDERS HCAR2, PAH, PTGES2 MEN1 4724/4885KMT2A 2304/4885RAB9A 3904/4885

“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.