SCHEMBL10136175

SCHEMBL10136175

CCC(C)(C)C(=O)OCCNC(=O)Nc1cccc2ccc(C)nc12

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TP53 P04637 4/20 0.49
POLB P06746 3/20 0.46
MAPT P10636 4/20 0.46
GAA P10253 1/20 0.44
THRB P10828 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
ALDH1A1 P00352 2/20 0.42
TSHR P16473 1/20 0.42
HSD17B10 Q99714 1/20 0.42
MEN1 O00255 1/20 0.42
ALOX12 P18054 1/20 0.42
KMT2A Q03164 1/20 0.42
GLO1 Q04760 1/20 0.42
LMNA P02545 1/20 0.41
EPHX1 P07099 1/20 0.40
HDAC6 Q9UBN7 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
SCHEMBL13667488 0.81 EPHX1 (0.63) POLBMAPTALDH1A1HSD17B10MEN1
SCHEMBL10165659 0.81 EPHX1 (0.48) GAAALDH1A1HSD17B10MEN1ALOX12
SCHEMBL12602789 0.81 TP53 (0.48) TP53POLBMAPTGAATHRB
SCHEMBL13667491 0.80 ITGB3 (0.54) POLBMAPTGAASMN1; SMN2ALDH1A1
SCHEMBL12883766 0.78 RAB9A (0.45) POLBMAPTGAATHRBSMN1; SMN2
SCHEMBL12793197 0.78 TP53 (0.50) TP53POLBMAPTGAATHRB
SCHEMBL12934610 0.75 ALDH1A1 (0.41) POLBMAPTGAATHRBSMN1; SMN2
SCHEMBL13223598 0.75 POLB (0.40) POLBGAASMN1; SMN2ALDH1A1MEN1
SCHEMBL12948858 0.74 TP53 (0.51) TP53POLBMAPTGAATHRB
SCHEMBL10136182 0.74 MAOA (0.49) POLBMAPTGAASMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8529044-B2 Ink composition, ink set, and method of forming image FUJIFILM CORPORATION (JP) 2013-09-10 US disclosed
US-20120026240-A1 INK COMPOSITION, INK SET, AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2012-02-02 US disclosed
US-20110057982-A1 INK COMPOSITION, INK SET, AND METHOD OF FORMING IMAGE FUJIFILM CORPORATION (JP) 2011-03-10 US disclosed