SCHEMBL9306549

SCHEMBL9306549

CN(C)c1cccc(C(=O)CC(=O)C(C)(C)C)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
HSD17B10 Q99714 3/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
GFER P55789 1/20 0.49
KMT2A Q03164 3/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
POLB P06746 3/20 0.47
LMNA P02545 2/20 0.47
ALDH1A1 P00352 3/20 0.46
MAPT P10636 2/20 0.46
HPGD P15428 2/20 0.46
ALOX15 P16050 1/20 0.46
PTPN1 P18031 1/20 0.46
USP2 O75604 1/20 0.44
HTT P42858 1/20 0.44
RAF1 P04049 1/20 0.44
NAMPT P43490 1/20 0.43
HDAC1 Q13547 1/20 0.43

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
SCHEMBL9481732 0.85 ERCC5 (0.47) KDM4ESMN1; SMN2HSD17B10NPC1RAB9A
SCHEMBL5740022 0.82 KDM4E (0.52) KDM4ESMN1; SMN2HSD17B10NPC1RAB9A
SCHEMBL1698313 0.80 ALDH1A1 (0.52) KDM4ESMN1; SMN2HSD17B10NPC1RAB9A
SCHEMBL941088 0.78 KMT2A (0.54) KDM4ESMN1; SMN2HSD17B10NPC1RAB9A
SCHEMBL16886343 0.78 KMT2A (0.50) KDM4ESMN1; SMN2HSD17B10NPC1RAB9A
SCHEMBL11108445 0.78 KMT2A (0.58) KDM4ESMN1; SMN2HSD17B10NPC1RAB9A
SCHEMBL338575 0.77 KMT2A (0.53) KDM4ESMN1; SMN2HSD17B10NPC1RAB9A
SCHEMBL6496987 0.77 KMT2A (0.53) KDM4ESMN1; SMN2HSD17B10NPC1RAB9A
Hydrochloric Acid SCHEMBL7312871 0.77 KMT2A (0.53) KDM4ESMN1; SMN2HSD17B10NPC1RAB9A
SCHEMBL556208 0.77 KMT2A (0.53) KDM4ESMN1; SMN2HSD17B10NPC1RAB9A

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
US-5371296-A Light stability, sunburn prevention KAO CORPORATION (JP) 1994-12-06 US claimed
EP-0504844-A2 4,4-Dimethyl-1-phenylpentane-1,3-dione derivative and UV ray absorbent and cosmetic containing the same KAO CORPORATION (JP) 1992-09-23 EP claimed
JP-4290842-A None JP disclosed
US-5371296-A Light stability, sunburn prevention KAO CORPORATION (JP) 1994-12-06 US disclosed
US-5191121-A Sunscreen KAO CORPORATION (JP) 1993-03-02 US disclosed
JP-H04290842-A BENZOYLPINACOLONE DERIVATIVE, ULTRAVIOLET LIGHT ABSORBER AND COSMETIC CONTAINING THE SAME DERIVATIVE KAO CORP 1992-10-15 JP disclosed
EP-0504844-A2 4,4-Dimethyl-1-phenylpentane-1,3-dione derivative and UV ray absorbent and cosmetic containing the same KAO CORPORATION (JP) 1992-09-23 EP disclosed