SCHEMBL19007790

SCHEMBL19007790

CSc1ccc(C(=O)C(C)(C)N(CCO)CCO)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
TSHR P16473 3/20 0.46
MAPK1 P28482 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
PLK1 P53350 1/20 0.42
EPHX2 P34913 1/20 0.41
NR1H4 Q96RI1 1/20 0.41
HAO1 Q9UJM8 1/20 0.39
TAS1R3 Q7RTX0 1/20 0.38
TAS1R1 Q7RTX1 1/20 0.38
HTT P42858 1/20 0.36
HPGD P15428 2/20 0.36
HSD17B10 Q99714 2/20 0.36
POLB P06746 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
CASP3 P42574 1/20 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
SCHEMBL725568 0.87 ALDH1A1 (0.46) ALDH1A1TSHRMAPK1SMN1; SMN2PLK1
SCHEMBL726032 0.85 ALDH1A1 (0.47) ALDH1A1TSHRMAPK1SMN1; SMN2PLK1
SCHEMBL19007785 0.84 CA2 (0.41) ALDH1A1TSHRMAPK1SMN1; SMN2HPGD
SCHEMBL10885564 0.84 RAB9A (0.43) ALDH1A1TSHRMAPK1SMN1; SMN2TAS1R3
SCHEMBL727211 0.84 TSHR (0.43) ALDH1A1TSHRMAPK1SMN1; SMN2PLK1
SCHEMBL726067 0.83 SMN1; SMN2 (0.43) ALDH1A1TSHRMAPK1SMN1; SMN2PLK1
SCHEMBL725631 0.83 MLYCD (0.44) ALDH1A1TSHRMAPK1SMN1; SMN2PLK1
SCHEMBL10885979 0.82 ALDH1A1 (0.46) ALDH1A1TSHRMAPK1SMN1; SMN2PLK1
SCHEMBL58563 0.80 ALDH1A1 (0.50) ALDH1A1TSHRMAPK1SMN1; SMN2PLK1
SCHEMBL725753 0.78 TSHR (0.47) ALDH1A1TSHRMAPK1SMN1; SMN2PLK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3412694-B1 AQUEOUS DISPERSION, METHOD FOR MANUFACTURING THE SAME, AND IMAGE FORMING METHOD FUJIFILM CORP (JP) 2021-12-08 EP disclosed
US-20190023918-A1 AQUEOUS DISPERSION, METHOD FOR MANUFACTURING THE SAME, AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2019-01-24 US disclosed
US-20170174916-A1 GEL PARTICLES, PHOTOSENSITIVE COMPOSITION, INK COMPOSITION, METHOD OF PRODUCING WATER DISPERSION OF GEL PARTICLES, AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2017-06-22 US disclosed
US-20170174916-A1 GEL PARTICLES, PHOTOSENSITIVE COMPOSITION, INK COMPOSITION, METHOD OF PRODUCING WATER DISPERSION OF GEL PARTICLES, AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2017-06-22 US disclosed