SCHEMBL5796166

SCHEMBL5796166

COc1ccc(C=O)cc1NC(=O)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.58
KDM4E B2RXH2 4/20 0.58
HTT P42858 3/20 0.58
KMT2A Q03164 3/20 0.58
TUBB4A P04350 1/20 0.55
TUBB P07437 1/20 0.55
TUBA3C P0DPH7 1/20 0.55
TUBA1B P68363 1/20 0.55
TUBA4A P68366 1/20 0.55
TUBB4B P68371 1/20 0.55
TUBB3 Q13509 1/20 0.55
TUBB2A Q13885 1/20 0.55
TUBB8 Q3ZCM7 1/20 0.55
TUBA3E Q6PEY2 1/20 0.55
TUBA1A Q71U36 1/20 0.55
TUBA1C Q9BQE3 1/20 0.55
TUBB6 Q9BUF5 1/20 0.55
TUBB2B Q9BVA1 1/20 0.55
TUBB1 Q9H4B7 1/20 0.55
TP53 P04637 1/20 0.54

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
SCHEMBL15652568 0.89 NR1H4 (0.60) MAPTKDM4EHTTKMT2ATP53
SCHEMBL5789931 0.87 MAPT (0.74) MAPTKDM4EHTTKMT2ATP53
SCHEMBL5757229 0.82 MAPT (0.65) MAPTKDM4EHTTKMT2ATP53
SCHEMBL3755964 0.81 MAPT (0.78) MAPTKDM4EHTTKMT2ATP53
SCHEMBL6504855 0.80 PPARD (0.65) HDAC1HDAC6
SCHEMBL8011597 0.79 MLYCD (0.77) MAPTKDM4EHTTKMT2AHPGD
SCHEMBL12764349 0.78 MAPT (0.65) MAPTKDM4EHTTKMT2ATP53
SCHEMBL1547783 0.77 KMT2A (0.53) KMT2APOLBALDH1A1HPGDHDAC1
SCHEMBL6670831 0.77 ALDH1A1 (0.56) MAPTKDM4EHTTKMT2AMAPK1
SCHEMBL29951436 0.77 ALDH1A1 (0.56) MAPTKDM4EHTTKMT2AMAPK1

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
WO-2006041921-A2 PREPARATION AND USES OF RHODANINE DERIVATIVES AUSPEX PHARMACEUTICALS, INC. (US) 2006-04-20 WO disclosed