SCHEMBL10872467

SCHEMBL10872467

[CH2]c1ccccc1C(=O)CC(C)C

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
TSHR P16473 1/20 0.43
GRM2 Q14416 3/20 0.40
SLC25A5 P05141 1/20 0.40
FFAR1 O14842 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ALOX15 P16050 1/20 0.38
MIF P14174 1/20 0.38
LMNA P02545 2/20 0.38
HPGD P15428 2/20 0.38
MAPT P10636 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
F2R P25116 1/20 0.37
LTB4R2 Q9NPC1 1/20 0.37

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
SCHEMBL13257558 0.82 ALDH1A1 (0.56) ALDH1A1TSHRGRM2ALOX15HPGD
SCHEMBL13647199 0.78 ERCC5 (0.55) ALDH1A1TSHRGRM2MEN1KMT2A
SCHEMBL27925176 0.78 FFAR1 (0.48) ALDH1A1TSHRFFAR1MEN1KMT2A
SCHEMBL8635130 0.78 ALDH1A1 (0.44) ALDH1A1TSHRGRM2SLC25A5FFAR1
SCHEMBL7220374 0.78 L3MBTL1 (0.44) ALDH1A1TSHRMEN1KMT2AALOX15
SCHEMBL5951330 0.77 F2R (0.52) ALDH1A1TSHRGRM2MEN1KMT2A
SCHEMBL1260279 0.77 ALDH1A1 (0.49) ALDH1A1TSHRGRM2SLC25A5HPGD
SCHEMBL11650545 0.77 ERCC5 (0.53) ALDH1A1MEN1KMT2ALMNAHPGD
SCHEMBL5847102 0.77 PTPN1 (0.53) ALDH1A1TSHRGRM2MEN1KMT2A
SCHEMBL12475421 0.77 TSHR (0.43) ALDH1A1TSHRGRM2SLC25A5FFAR1

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-0192167-A1 Use of thio-substitued ketones as photoinitiators MERCK PATENT GmbH (DE) 1986-08-27 EP disclosed