SCHEMBL787473

SCHEMBL787473

CC1=CCc2cc3ccccc3cc2C1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
ALDH1A1 P00352 3/20 0.36
TP53 P04637 3/20 0.36
HPGD P15428 3/20 0.36
LMNA P02545 2/20 0.36
GAA P10253 2/20 0.36
ATM Q13315 2/20 0.36
MAPK1 P28482 2/20 0.36
HIF1A Q16665 2/20 0.36
PLIN1 O60240 1/20 0.36
NR1I2 O75469 1/20 0.36
USP2 O75604 1/20 0.36
GSR P00390 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
CYP2D6 P10635 1/20 0.36
MAPT P10636 1/20 0.36
HSPD1 P10809 1/20 0.36

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
SCHEMBL396140 0.77 MAOA (0.50) MEN1KMT2AALDH1A1TP53HPGD
SCHEMBL8344964 0.74 METAP1 (0.53) ALDH1A1MAOAMAOBSMN1; SMN2HSD17B10
SCHEMBL12746735 0.72 MAOA (0.54) MEN1KMT2AALDH1A1TP53HPGD
SCHEMBL16319861 0.70 APEX1 (0.50) ALDH1A1HPGDLMNAMYC
SCHEMBL307693 0.69 MEN1 (0.38) MEN1KMT2AALDH1A1TP53HPGD
SCHEMBL19770684 0.69 MEN1 (0.42) MEN1KMT2AALDH1A1TP53HPGD
SCHEMBL1160392 0.69 KDM4E (0.33) MEN1KMT2AALDH1A1GAA
SCHEMBL10446178 0.68 ALDH1A1 (0.64) MEN1KMT2AALDH1A1TP53HPGD
SCHEMBL28033678 0.68 GRM5 (0.46) MEN1KMT2AALDH1A1TP53HPGD
Hydrochloric Acid SCHEMBL8159133 0.68 MEN1 (0.31) MEN1KMT2A

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
EP-2436837-B1 METHOD FOR DIGESTING LIGNOCELLULOSIC MATERIAL JUJO PAPER CO LTD (JP) 2018-09-19 EP disclosed
US-9145642-B2 Cooking process of lignocellulose material NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2015-09-29 US disclosed
US-20120067533-A1 COOKING PROCESS OF LIGNOCELLULOSE MATERIAL SURGICAL INNOVATIONS V.O.F. (NL) 2012-03-22 US disclosed