SCHEMBL9505246

SCHEMBL9505246

CC(=O)CC(=O)NC1C=CC2NC(=O)NC(=O)C2C1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
RGS12 O14924 1/20 0.31
TSHR P16473 1/20 0.31
GAA P10253 1/20 0.31
LMNA P02545 1/20 0.30
TLR4 O00206 1/20 0.30

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
SCHEMBL10774339 0.70 TSHR (0.41) ALDH1A1MAPTTSHRLMNA
SCHEMBL9507447 0.68 ALDH1A1 (0.33) ALDH1A1MAPTGAALMNA
Acetic Acid SCHEMBL1801429 0.64 ALDH1A1 (0.33) ALDH1A1MAPTTSHR
SCHEMBL127815 0.59 BACE1 (0.38) ALDH1A1MAPTTSHR
SCHEMBL17541719 0.59 BACE1 (0.42) ALDH1A1MAPTTSHR
SCHEMBL10173715 0.56 GAA (0.50) ALDH1A1MAPTRGS12TSHRGAA
SCHEMBL13473788 0.56 TSHR (0.66) ALDH1A1RGS12TSHRGAALMNA
SCHEMBL8812371 0.56
SCHEMBL14499553 0.56 GAA (0.50) ALDH1A1MAPTRGS12TSHRGAA
Acetoacetic Acid SCHEMBL2763489 0.56 HSD17B10 (0.38) ALDH1A1MAPTRGS12TSHRGAA

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 6 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-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