SCHEMBL8090581

SCHEMBL8090581

CC(C)[C@H](N)C(=O)CC(=O)Nc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.51
LMNA P02545 1/20 0.51
HPGD P15428 1/20 0.51
HDAC3 O15379 3/20 0.51
HDAC4 P56524 3/20 0.51
HDAC1 Q13547 3/20 0.51
HDAC7 Q8WUI4 3/20 0.51
HDAC2 Q92769 3/20 0.51
HDAC10 Q969S8 3/20 0.51
HDAC11 Q96DB2 3/20 0.51
HDAC8 Q9BY41 3/20 0.51
HDAC6 Q9UBN7 3/20 0.51
HDAC9 Q9UKV0 3/20 0.51
HDAC5 Q9UQL6 3/20 0.51
MAPT P10636 2/20 0.50
TSHR P16473 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
LTA4H P09960 1/20 0.48
GAA P10253 1/20 0.47
SCN1A P35498 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
SCHEMBL8090578 1.00 KDM1A (0.51) KDM1ALMNAHPGDHDAC3HDAC4
SCHEMBL925581 0.82 HPGD (0.57) KDM1ALMNAHPGDHDAC3HDAC4
Water SCHEMBL27408001 0.81 HPGD (0.56) KDM1ALMNAHPGDHDAC3HDAC4
SCHEMBL10789076 0.81 LMNA (0.53) KDM1ALMNAHPGDHDAC3HDAC4
Hydrochloric Acid SCHEMBL10793382 0.80 LMNA (0.51) KDM1ALMNAHPGDHDAC3HDAC4
SCHEMBL31112221 0.79 LMNA (0.54) KDM1ALMNAHPGDHDAC3HDAC4
SCHEMBL24832296 0.79 TAAR1 (0.59) LMNAHPGDMAPTTSHRLTA4H
SCHEMBL836046 0.79 TAAR1 (0.59) LMNAHPGDMAPTTSHRLTA4H
SCHEMBL835887 0.79 TAAR1 (0.59) LMNAHPGDMAPTTSHRLTA4H
Hydrochloric Acid SCHEMBL31491245 0.77 TAAR1 (0.57) LMNAHPGDMAPTTSHRLTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6043014-A Imaging elements comprising an electrically-conductive layer and a protective overcoat composition containing a solvent-dispersible polyurethane EASTMAN KODAK COMPANY (US) 2000-03-28 US disclosed
US-4804619-A SHARPNESS, GRAININESS KONICA CORPORATION (JP) 1989-02-14 US disclosed
EP-0268150-A2 Silver halide color photographic light-sensitive material KONICA CORPORATION (JP) 1988-05-25 EP disclosed