SCHEMBL9507563

SCHEMBL9507563

CC(CC(=O)CC=O)ONc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.40
HPGD P15428 2/20 0.40
TSHR P16473 1/20 0.38
GAA P10253 5/20 0.37
SMN1; SMN2 Q16637 5/20 0.37
F2R P25116 1/20 0.36
RAB9A P51151 1/20 0.35
MME P08473 1/20 0.35
ACE P12821 1/20 0.35
HTT P42858 2/20 0.35
RECQL P46063 2/20 0.35
MAOB P27338 1/20 0.35
HDAC3 O15379 4/20 0.35
HDAC4 P56524 4/20 0.35
HDAC1 Q13547 4/20 0.35
HDAC7 Q8WUI4 4/20 0.35
HDAC2 Q92769 4/20 0.35
HDAC10 Q969S8 4/20 0.35
HDAC11 Q96DB2 4/20 0.35
HDAC8 Q9BY41 4/20 0.35

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
SCHEMBL4544093 0.83 GAA (0.36) LMNAHPGDGAASMN1; SMN2HDAC3
SCHEMBL5947511 0.80 LMNA (0.44) LMNAHPGDTSHRGAARAB9A
SCHEMBL942415 0.80 TSHR (0.43) LMNAHPGDTSHRGAASMN1; SMN2
SCHEMBL812821 0.72 TDP1 (0.40) LMNAHPGDTSHRGAASMN1; SMN2
SCHEMBL809522 0.72 TDP1 (0.40) LMNAHPGDTSHRGAASMN1; SMN2
SCHEMBL7679994 0.71 CYP1A2 (0.37) TSHRSMN1; SMN2RAB9AHTTMAOB
SCHEMBL2257955 0.70 TDP1 (0.41) LMNAHPGDTSHRGAASMN1; SMN2
SCHEMBL28305020 0.69 MAOB (0.57) TSHRGAASMN1; SMN2HTTMAOB
SCHEMBL2255542 0.69 TDP1 (0.48) LMNAHPGDTSHRGAASMN1; SMN2
SCHEMBL14292863 0.69 ALDH1A1 (0.40) LMNAHPGDTSHRGAASMN1; 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0412121-B1 AZO PIGMENT COMPOSITION HAVING IMPROVED PROCESS HEAT STABILITY AND DRIED INK TRANSPARENCY HOECHST CELANESE CORPORATION (US) 1993-07-28 EP claimed
EP-0412121-A1 AZO PIGMENT COMPOSITION HAVING IMPROVED PROCESS HEAT STABILITY AND DRIED INK TRANSPARENCY. HOECHST CELANESE CORP (US) 1991-02-13 EP claimed
WO-1989010385-A1 AZO PIGMENT COMPOSITION HAVING IMPROVED PROCESS HEAT STABILITY AND DRIED INK TRANSPARENCY HOECHST CELANESE CORPORATION (US) 1989-11-02 WO claimed
EP-0412121-B1 AZO PIGMENT COMPOSITION HAVING IMPROVED PROCESS HEAT STABILITY AND DRIED INK TRANSPARENCY HOECHST CELANESE CORPORATION (US) 1993-07-28 EP disclosed
EP-0412121-A1 AZO PIGMENT COMPOSITION HAVING IMPROVED PROCESS HEAT STABILITY AND DRIED INK TRANSPARENCY. HOECHST CELANESE CORP (US) 1991-02-13 EP disclosed
US-4968352-A Diaryl pigments with improved heat stability and transparency containing coupled mixed bis-diazotized diamines and acid-substituted aromatic amines HOECHST CELANESE CORPORATION (US) 1990-11-06 US disclosed
WO-1989010385-A1 AZO PIGMENT COMPOSITION HAVING IMPROVED PROCESS HEAT STABILITY AND DRIED INK TRANSPARENCY HOECHST CELANESE CORPORATION (US) 1989-11-02 WO disclosed
US-4665163-A YELLOW SHADES IN PLASTICS HOECHST AKTIENGESELLSCHAFT (DE) 1987-05-12 US disclosed