SCHEMBL3668638

SCHEMBL3668638

CN(Cc1cccc(-c2cc(C(F)(F)F)ccc2O)c1)C(=O)Nc1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MTOR P42345 2/20 0.64
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA9 Q16790 1/20 0.48
MAPT P10636 3/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
TP53 P04637 2/20 0.46
AOC3 Q16853 2/20 0.45
TACR1 P25103 2/20 0.43
DCUN1D1 Q96GG9 2/20 0.43
POLB P06746 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
KCNH2 Q12809 1/20 0.43
MGLL Q99685 1/20 0.42
HTT P42858 1/20 0.42
RAB9A P51151 1/20 0.42
UBE2M P61081 1/20 0.42

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
SCHEMBL3668636 0.90 MTOR (0.64) MTORCA12CA1CA2CA9
SCHEMBL3666332 0.85 MTOR (0.47) MTORMAPTTACR1POLBMGLL
SCHEMBL1948090 0.85 PTGDR2 (0.61) MTORRAB9A
SCHEMBL3671611 0.84 PDK1 (0.54) MEN1KMT2ATACR1
SCHEMBL3672481 0.82 MTOR (0.43) MTORAOC3TACR1POLB
SCHEMBL3666876 0.82 ABHD6 (0.54) MTORMEN1KMT2AAOC3TACR1
SCHEMBL3666867 0.78 HDAC6 (0.56) MEN1KMT2ATACR1
SCHEMBL3668839 0.77 NR1H3 (0.53) MEN1KMT2A
SCHEMBL3674358 0.77 MTOR (0.56) MTORMAPTTP53TACR1
SCHEMBL12564544 0.76 PTGDR2 (0.52) MTORRAB9A

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-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