SCHEMBL3666331

SCHEMBL3666331

CN(Cc1cccc(-c2cc(C(F)(F)F)ccc2[O])c1)C(=O)Nc1ccccn1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MTOR P42345 1/20 0.47
TACR1 P25103 6/20 0.41
BRAF P15056 1/20 0.40
NR3C2 P08235 1/20 0.38
ROCK2 O75116 1/20 0.38
ROCK1 Q13464 1/20 0.38
MGLL Q99685 1/20 0.38
MTTP P55157 1/20 0.38
POLB P06746 1/20 0.37
MAPT P10636 1/20 0.37
APEX1 P27695 1/20 0.37
MAPK14 Q16539 1/20 0.37
POLQ O75417 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
SCHEMBL3666332 0.91 MTOR (0.47) MTORTACR1BRAFNR3C2ROCK2
SCHEMBL1949600 0.86 PTGDR2 (0.56) MTOR
SCHEMBL3668636 0.85 MTOR (0.64) MTORTACR1MGLLMAPT
SCHEMBL3671898 0.81 LIPE (0.46) MTORTACR1BRAFMGLLPOLQ
SCHEMBL3671609 0.78 MLYCD (0.52) MTORTACR1
SCHEMBL3672476 0.78 MTOR (0.43) MTORTACR1POLB
SCHEMBL3666874 0.76 ABHD6 (0.54) MTORTACR1MGLL
SCHEMBL3668638 0.76 MTOR (0.64) MTORTACR1MGLLPOLBMAPT
SCHEMBL3670285 0.76 TRPV4 (0.43) TACR1BRAFMGLL
SCHEMBL1948090 0.73 PTGDR2 (0.61) MTOR

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
EP-2240434-A1 2-PHENYL PHENOXYACETIC ACIDS USEFUL FOR TREATING INFLAMMATORY DISORDERS Ligand Pharmaceuticals Inc. (US) 2010-10-20 EP claimed
WO-2009089192-A1 2-PHENYL PHENOXYACETIC ACIDS USEFUL FOR TREATING INFLAMMATORY DISORDERS LIGAND PHARMACEUTICALS INC. (US) 2009-07-16 WO claimed
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