SCHEMBL11554157

SCHEMBL11554157

O=C(Cl)c1[nH]c2ccc(C(O)(C(F)(F)F)C(F)(F)F)cc2c1-c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 4/20 0.53
MAP2 P11137 5/20 0.51
ALDH1A1 P00352 5/20 0.48
KDM4E B2RXH2 4/20 0.48
HPGD P15428 3/20 0.48
MEN1 O00255 1/20 0.48
HTT P42858 1/20 0.48
GFER P55789 1/20 0.48
KMT2A Q03164 1/20 0.48
HSD17B10 Q99714 1/20 0.48
TUBB4A P04350 1/20 0.47
TUBB P07437 1/20 0.47
TUBA3C P0DPH7 1/20 0.47
TUBA1B P68363 1/20 0.47
TUBA4A P68366 1/20 0.47
TUBB4B P68371 1/20 0.47
TUBB3 Q13509 1/20 0.47
TUBB2A Q13885 1/20 0.47
TUBB8 Q3ZCM7 1/20 0.47
TUBA3E Q6PEY2 1/20 0.47

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
SCHEMBL11554945 0.90 MAP2 (0.60) PGRMAP2ALDH1A1KDM4EHPGD
SCHEMBL11550795 0.88 MAP2 (0.65) PGRMAP2ALDH1A1KDM4EHPGD
SCHEMBL11551322 0.82 ALDH1A1 (0.66) PGRMAP2ALDH1A1KDM4EHPGD
SCHEMBL2716626 0.78 MAP2 (0.81) MAP2ALDH1A1KDM4EHPGDMEN1
SCHEMBL11555822 0.77 PGR (0.54) PGRMEN1KMT2A
SCHEMBL18092657 0.72 MAPT (0.81) MAP2ALDH1A1KDM4EHPGDMEN1
SCHEMBL1356850 0.71 ALDH1A1 (0.70) MAP2ALDH1A1KDM4EHPGDMEN1
SCHEMBL13705673 0.70 PGR (1.00) PGRALDH1A1KDM4EMEN1KMT2A
SCHEMBL215691 0.68 MAP2 (0.79) MAP2ALDH1A1KDM4EHPGDMEN1
SCHEMBL42364 0.68 MAP2 (1.00) MAP2ALDH1A1KDM4EHPGDMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4156016-A ANTICOAGULANTS HOFFMANN-LA ROCHE INC. (US) 1979-05-22 US disclosed