SCHEMBL11906285

SCHEMBL11906285

CC(C)(C)c1ccc2c(C(C)(C)C)c(O)ccc2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.53
HPGD P15428 1/20 0.53
ALOX15 P16050 1/20 0.53
HSD17B10 Q99714 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
MAPT P10636 3/20 0.48
MEN1 O00255 3/20 0.48
GAA P10253 3/20 0.48
KMT2A Q03164 3/20 0.48
PKM P14618 2/20 0.48
RECQL P46063 1/20 0.48
NR1I2 O75469 1/20 0.43
CYP2D6 P10635 3/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
POLB P06746 1/20 0.41
LMNA P02545 1/20 0.39
TYR P14679 1/20 0.39
SIRT1 Q96EB6 1/20 0.39
ESR1 P03372 2/20 0.38
HSP90AA1 P07900 1/20 0.38

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
SCHEMBL19196663 0.83 ALDH1A1 (0.55) ALDH1A1HPGDALOX15HSD17B10TDP1
SCHEMBL7629173 0.83 ALDH1A1 (0.55) ALDH1A1HPGDALOX15HSD17B10TDP1
SCHEMBL10946476 0.81 ESR1 (0.54) ALDH1A1HPGDALOX15HSD17B10TDP1
SCHEMBL19196115 0.79 ALDH1A1 (0.50) ALDH1A1HPGDALOX15HSD17B10TDP1
SCHEMBL6399203 0.77 ALDH1A1 (0.48) ALDH1A1HPGDALOX15HSD17B10TDP1
SCHEMBL722323 0.77 ALDH1A1 (0.57) ALDH1A1HPGDALOX15HSD17B10TDP1
SCHEMBL6557124 0.76 ALDH1A1 (0.47) ALDH1A1HPGDALOX15HSD17B10TDP1
SCHEMBL27010673 0.76 ALDH1A1 (0.47) ALDH1A1HPGDALOX15HSD17B10TDP1
SCHEMBL4010301 0.76 ERN1 (0.59) ALDH1A1HPGDALOX15HSD17B10TDP1
SCHEMBL19798871 0.76 PLAU (0.53) ALDH1A1HPGDALOX15HSD17B10TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120205822-A1 RESIN COMPOSITION FOR ENCAPSULATING SEMICONDUCTOR AND SEMICONDUCTOR DEVICE USING THE RESIN COMPOSITION SUMITOMO BAKELITE CO., LTD. (JP) 2012-08-16 US disclosed