SCHEMBL8115282

SCHEMBL8115282

CCCCCCCCCCCCCCCCCCOC(=O)c1ccccc1NC=O

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.68
TSHR P16473 5/20 0.68
LMNA P02545 3/20 0.68
MAPK1 P28482 3/20 0.66
CYP3A4 P08684 2/20 0.66
TP53 P04637 1/20 0.66
L3MBTL1 Q9Y468 3/20 0.65
KDM4E B2RXH2 3/20 0.65
SMN1; SMN2 Q16637 2/20 0.65
MAPT P10636 1/20 0.65
HSD17B10 Q99714 2/20 0.60
POLB P06746 1/20 0.60
TDP1 Q9NUW8 2/20 0.59
CYP1A2 P05177 1/20 0.53
CYP2C19 P33261 1/20 0.53
ADRA1D P25100 1/20 0.48
ADRA1A P35348 1/20 0.48
ADRA1B P35368 1/20 0.48
CASP3 P42574 1/20 0.47
SENP8 Q96LD8 1/20 0.47

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
SCHEMBL8116376 1.00 ALDH1A1 (0.68) ALDH1A1TSHRLMNAMAPK1CYP3A4
SCHEMBL8122377 1.00 ALDH1A1 (0.68) ALDH1A1TSHRLMNAMAPK1CYP3A4
SCHEMBL8114778 1.00 ALDH1A1 (0.68) ALDH1A1TSHRLMNAMAPK1CYP3A4
SCHEMBL8117419 1.00 ALDH1A1 (0.68) ALDH1A1TSHRLMNAMAPK1CYP3A4
SCHEMBL8123323 1.00 ALDH1A1 (0.68) ALDH1A1TSHRLMNAMAPK1CYP3A4
SCHEMBL8119743 1.00 ALDH1A1 (0.68) ALDH1A1TSHRLMNAMAPK1CYP3A4
SCHEMBL8120809 1.00 ALDH1A1 (0.68) ALDH1A1TSHRLMNAMAPK1CYP3A4
SCHEMBL8117059 1.00 ALDH1A1 (0.68) ALDH1A1TSHRLMNAMAPK1CYP3A4
SCHEMBL8115841 1.00 ALDH1A1 (0.68) ALDH1A1TSHRLMNAMAPK1CYP3A4
SCHEMBL8106813 1.00 ALDH1A1 (0.68) ALDH1A1TSHRLMNAMAPK1CYP3A4

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
US-6114546-A Aminomethylene derivatives and ultraviolet absorbent comprising thereof CHEMIPRO KASEI KAISHA, LIMITED (JP) 2000-09-05 US disclosed
EP-0950655-A1 AMINOMETHYLENE DERIVATIVES AND ULTRAVIOLET ABSORBER COMPRISING THE SAME CHEMIPRO KASEI KAISHA, LIMITED (JP) 1999-10-20 EP disclosed