SCHEMBL10442014

SCHEMBL10442014

Cc1cccc(C(=O)NC(C)c2cccs2)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.60
TP53 P04637 2/20 0.55
ATM Q13315 1/20 0.53
KCNK3 O14649 2/20 0.52
KCNK9 Q9NPC2 2/20 0.52
HPGD P15428 2/20 0.52
MAPT P10636 2/20 0.52
ALDH1A1 P00352 1/20 0.52
POLB P06746 1/20 0.52
TAS1R3 Q7RTX0 1/20 0.51
TAS1R1 Q7RTX1 1/20 0.51
HTT P42858 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C19 P33261 1/20 0.50
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49

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
SCHEMBL10441844 0.85 HPGD (0.64) KDM4EATMHPGDMAPTALDH1A1
SCHEMBL10441789 0.84 RAB9A (0.54) HPGDMAPTALDH1A1POLBL3MBTL1
SCHEMBL2653231 0.84 ALDH1A1 (0.58) HPGDMAPTALDH1A1POLBL3MBTL1
SCHEMBL10441850 0.83 POLB (0.57) KDM4ETP53HPGDMAPTALDH1A1
SCHEMBL10441852 0.83 MAPT (0.68) KDM4EHPGDMAPTALDH1A1TAS1R3
SCHEMBL10441936 0.82 NPSR1 (0.65) KDM4EKCNK3KCNK9HPGDMAPT
SCHEMBL10441798 0.80 ALDH1A1 (0.49) KDM4ETP53HPGDMAPTALDH1A1
SCHEMBL10441795 0.80 MEN1 (0.57) KDM4ETP53HPGDMAPTALDH1A1
SCHEMBL13761410 0.77 RAB9A (0.76) KDM4ETP53ATMKCNK3KCNK9
SCHEMBL2712626 0.77 ALDH1A1 (0.49) KDM4EHPGDMAPTALDH1A1POLB

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
EP-0348505-A1 NOVEL N-(1-THIENYLETHYL)AMINE DERIVATIVES AND HERBICIDES CONTAINING THE SAME AS EFFECTIVE INGREDIENT DAIKIN INDUSTRIES, LIMITED (JP) 1990-01-03 EP disclosed