SCHEMBL9850647

SCHEMBL9850647

CC(CN(C)C)C(=O)c1ccc(C(C)C)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.50
HPGD P15428 1/20 0.49
USP5 P45974 1/20 0.46
HDAC3 O15379 1/20 0.45
HDAC4 P56524 1/20 0.45
HDAC1 Q13547 1/20 0.45
HDAC7 Q8WUI4 1/20 0.45
HDAC2 Q92769 1/20 0.45
HDAC10 Q969S8 1/20 0.45
HDAC11 Q96DB2 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
HDAC9 Q9UKV0 1/20 0.45
HDAC5 Q9UQL6 1/20 0.45
HTT P42858 4/20 0.44
RAB9A P51151 4/20 0.44
ATM Q13315 2/20 0.44
NPC1 O15118 2/20 0.44
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44

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
Hydrochloric Acid SCHEMBL10353456 0.89 EGFR (0.58) EGFRHDAC3HDAC4HDAC1HDAC7
SCHEMBL9859087 0.86 EGFR (0.50) EGFRHPGDHDAC3HDAC4HDAC1
SCHEMBL9850638 0.84 CHRM2 (0.51) EGFRHPGDHDAC3HDAC4HDAC1
SCHEMBL10384775 0.82 EGFR (0.50) EGFRHPGDHDAC3HDAC4HDAC1
SCHEMBL9683311 0.81 NPC1 (0.64) EGFRHDAC3HDAC4HDAC1HDAC7
SCHEMBL6726553 0.81 NPC1 (0.64) EGFRHDAC3HDAC4HDAC1HDAC7
Hydrochloric Acid SCHEMBL9324495 0.80 MAPT (0.67) EGFRHDAC3HDAC4HDAC1HDAC7
SCHEMBL8970946 0.79 USP5 (0.50) HPGDUSP5HDAC3HDAC4HDAC1
SCHEMBL7590256 0.79 ALDH1A1 (0.56) EGFRHPGDHDAC3HDAC4HDAC1
SCHEMBL11497403 0.79 HTT (0.64) EGFRHPGDHDAC3HDAC4HDAC1

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-0423524-A2 Propiophenone derivatives and their preparation and pharmaceutical use MARUHO Co., Ltd. (JP) 1991-04-24 EP disclosed