SCHEMBL3401503

SCHEMBL3401503

C=C(C(=O)O)c1cccc2c1C(O)c1ccccc1-2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2B P41595 6/20 0.37
HNF4A P41235 1/20 0.37
PPIA P62937 1/20 0.36
ALDH1A1 P00352 3/20 0.36
MAPT P10636 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
LMNA P02545 1/20 0.36
KDM4E B2RXH2 2/20 0.36
MEN1 O00255 1/20 0.36
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
HTR7 P34969 5/20 0.35
HDAC3 O15379 1/20 0.34
HDAC4 P56524 1/20 0.34

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
SCHEMBL67620 0.83 HNF4A (0.49) HTR2BHNF4APPIAALDH1A1MAPT
Dimethylamine SCHEMBL28738763 0.78 HNF4A (0.44) HTR2BHNF4APPIAALDH1A1MAPT
SCHEMBL11123891 0.71 ALDH1A1 (0.52) ALDH1A1MAPTKDM4ESMN1; SMN2HDAC8
SCHEMBL7324096 0.71 CHRNB2 (0.45) HTR2BHNF4AALDH1A1MAPTKDM4E
SCHEMBL4586611 0.70 ALDH1A1 (0.55) ALDH1A1MAPTLMNAKDM4ETP53
Formaldehyde SCHEMBL28887991 0.69 HTR2B (0.47) HTR2BALDH1A1MAPTKDM4EMEN1
SCHEMBL27892791 0.69 HNF4A (0.47) HTR2BHNF4AALDH1A1MAPTL3MBTL1
SCHEMBL11783880 0.69 HTR2B (0.51) HTR2BALDH1A1MAPTKDM4EMEN1
SCHEMBL1261847 0.69 MEN1 (0.45) HTR2BPPIAALDH1A1MAPTL3MBTL1
SCHEMBL556351 0.69 BCAT2 (0.59) HNF4AALDH1A1LMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2256170-B1 Tunable fluorescent UV curable gel inks containing fluorescent monomers for food packaging applications XEROX CORP (US) 2014-12-24 EP claimed
US-20100304040-A1 TUNABLE FLUORESCENT UV CURABLE GEL INKS CONTAINING FLUORESCENT MONOMERS FOR FOOD PACKAGING APPLICATIONS XEROX CORPORATION (US) 2010-12-02 US claimed
EP-2256170-A1 Tunable fluorescent UV curable gel inks containing fluorescent monomers for food packaging applications Xerox Corporation (US) 2010-12-01 EP claimed
EP-2256170-B1 Tunable fluorescent UV curable gel inks containing fluorescent monomers for food packaging applications XEROX CORP (US) 2014-12-24 EP disclosed
US-8334026-B2 Tunable fluorescent UV curable gel inks containing fluorescent monomers for food packaging applications XEROX CORPORATION (US) 2012-12-18 US disclosed
US-20100304040-A1 TUNABLE FLUORESCENT UV CURABLE GEL INKS CONTAINING FLUORESCENT MONOMERS FOR FOOD PACKAGING APPLICATIONS XEROX CORPORATION (US) 2010-12-02 US disclosed
EP-2256170-A1 Tunable fluorescent UV curable gel inks containing fluorescent monomers for food packaging applications Xerox Corporation (US) 2010-12-01 EP disclosed