SCHEMBL9745014

SCHEMBL9745014

CCCC(F)c1cccc2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 7/20 0.44
SMN1; SMN2 Q16637 7/20 0.44
ALDH1A1 P00352 6/20 0.44
MAPT P10636 6/20 0.44
L3MBTL1 Q9Y468 5/20 0.44
RAB9A P51151 4/20 0.44
EGFR P00533 3/20 0.44
LMNA P02545 3/20 0.44
TDP1 Q9NUW8 2/20 0.44
PABPC1 P11940 2/20 0.44
NSD2 O96028 1/20 0.44
KEAP1 Q14145 2/20 0.43
ADORA2A P29274 1/20 0.43
MAOA P21397 3/20 0.40
NPC1 O15118 3/20 0.39
CYP3A4 P08684 2/20 0.39
TSHR P16473 1/20 0.39
CASP3 P42574 1/20 0.39
HBB P68871 1/20 0.39
SENP7 Q9BQF6 1/20 0.39

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
SCHEMBL8772052 0.82 ALDH1A1 (0.45) MAPK1SMN1; SMN2ALDH1A1MAPTL3MBTL1
SCHEMBL5534332 0.81 MAPK1 (0.44) MAPK1SMN1; SMN2ALDH1A1MAPTL3MBTL1
SCHEMBL27575723 0.78 MAPK1 (0.41) MAPK1SMN1; SMN2ALDH1A1MAPTL3MBTL1
SCHEMBL9062726 0.76 ALDH1A1 (0.42) MAPK1SMN1; SMN2ALDH1A1MAPTL3MBTL1
SCHEMBL526407 0.75 TSHR (0.48) MAPK1SMN1; SMN2ALDH1A1MAPTL3MBTL1
SCHEMBL10433548 0.73 ADORA2A (0.53) MAPK1SMN1; SMN2ALDH1A1MAPTL3MBTL1
SCHEMBL7915851 0.73 ADORA2A (0.53) MAPK1SMN1; SMN2ALDH1A1MAPTL3MBTL1
SCHEMBL5790615 0.73 ALDH1A1 (0.37) MAPK1ALDH1A1MAPTRAB9ANPC1
SCHEMBL15924807 0.71 CA2 (0.40) SMN1; SMN2ALDH1A1KDM4E
SCHEMBL10940842 0.70 ALDH1A1 (0.50) MAPK1SMN1; SMN2ALDH1A1MAPTL3MBTL1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0497896-A1 NON-PHOTOGRAPHIC METHOD FOR PATTERNING ORGANIC POLYMER FILMS. DU PONT (US) 1992-08-12 EP disclosed
WO-1991006118-A1 NON-PHOTOGRAPHIC METHOD FOR PATTERNING ORGANIC POLYMER FILMS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-05-02 WO disclosed