SCHEMBL8798173

SCHEMBL8798173

CC(C)c1cccc(C(C)C)c1NC(=O)C1c2ccccc2COc2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.47
MAPT P10636 2/20 0.46
ALDH1A1 P00352 2/20 0.46
POLB P06746 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
GRM1 Q13255 1/20 0.46
KMT2A Q03164 3/20 0.45
LMNA P02545 1/20 0.45
HTT P42858 2/20 0.43
MEN1 O00255 2/20 0.43
L3MBTL1 Q9Y468 3/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HDAC4 P56524 2/20 0.40
HDAC7 Q8WUI4 2/20 0.40
HDAC5 Q9UQL6 2/20 0.40
HDAC3 O15379 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC2 Q92769 1/20 0.40

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
SCHEMBL8797449 0.89 LPAR1 (0.44) TP53MAPTALDH1A1POLBCYP1A2
SCHEMBL8797272 0.89 TP53 (0.45) TP53MAPTKMT2ALMNASMN1; SMN2
SCHEMBL8797883 0.89 LPAR1 (0.46) TP53MAPTALDH1A1POLBCYP1A2
SCHEMBL8797482 0.88 LPAR1 (0.45) TP53MAPTALDH1A1POLBCYP1A2
SCHEMBL8797024 0.88 GRM7 (0.41) TP53MAPTKMT2ALMNAHTT
SCHEMBL8797451 0.88 TP53 (0.39) TP53MAPTALDH1A1POLBCYP1A2
SCHEMBL8797541 0.88 LPAR1 (0.45) TP53MAPTALDH1A1POLBKMT2A
SCHEMBL8797529 0.87 TP53 (0.46) TP53MAPTALDH1A1POLBCYP1A2
SCHEMBL8797584 0.87 TBXAS1 (0.48) KMT2ALMNA
SCHEMBL8797368 0.86 TP53 (0.38) TP53KMT2ALMNAMEN1SMN1; SMN2

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-0497201-B1 Tricyclic compounds and intermediates thereof KYOWA HAKKO KOGYO KK (JP) 1997-01-15 EP disclosed
US-5478835-A Acyl coenzyme A: acyltransferase inhibitors; treatment of hyperlipemia and arteriosclerosis KYOWA HAKKO KOGYO CO., LTD. (JP) 1995-12-26 US disclosed
US-5340807-A Tricyclic compounds and intermediates thereof KYOWA HAKKO KOGYO CO., LTD. (JP) 1994-08-23 US disclosed
EP-0497201-A1 Tricyclic compounds and intermediates thereof KYOWA HAKKO KOGYO CO., LTD. (JP) 1992-08-05 EP disclosed