SCHEMBL5679554

SCHEMBL5679554

CC(C)(CO)Oc1ccc(C(C)(C)c2ccc(OC(C)(C)CO)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.43
TSHR P16473 3/20 0.43
CYP3A4 P08684 3/20 0.43
ESR1 P03372 3/20 0.43
ESR2 Q92731 3/20 0.43
AR P10275 2/20 0.43
SLC6A2 P23975 1/20 0.43
SLC6A4 P31645 1/20 0.43
HTR6 P50406 1/20 0.43
ESRRG P62508 1/20 0.43
SLC6A3 Q01959 1/20 0.43
HSD17B10 Q99714 1/20 0.43
ALDH1A1 P00352 4/20 0.41
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
TP53 P04637 2/20 0.41
MAPT P10636 2/20 0.41
HIF1A Q16665 2/20 0.41
PPARG P37231 2/20 0.41
CYP1A2 P05177 1/20 0.41

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
SCHEMBL10066481 0.93 ALDH1A1 (0.50) CYP3A4ESR1ESR2ALDH1A1MEN1
SCHEMBL22461066 0.91 AR (0.38) HPGDTSHRCYP3A4ESR1ESR2
SCHEMBL25463419 0.88 AR (0.39) HPGDTSHRCYP3A4ESR1ESR2
SCHEMBL9765846 0.88 SMN1; SMN2 (0.47) HPGDTSHRHSD17B10ALDH1A1MAPT
SCHEMBL18862666 0.81 CYP3A4 (0.60) TSHRCYP3A4ESR1ARSLC6A2
SCHEMBL1888745 0.81 MEN1 (0.50) HPGDTSHRCYP3A4ESR1ESR2
SCHEMBL13460970 0.81 ACHE (0.41) TSHRCYP3A4ALDH1A1MEN1KMT2A
SCHEMBL16585297 0.79 PPARA (0.38) PPARGPPARAABL1
SCHEMBL2229162 0.79 ALDH1A1 (0.44) HPGDTSHRCYP3A4ALDH1A1MAPT
SCHEMBL1892567 0.79 ALDH1A1 (0.41) ALDH1A1MEN1KMT2AMAPTPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12022921-B2 Decorative structure D. SWAROVSKI KG (AT) 2024-07-02 US disclosed
EP-0988335-B1 RADIATION CURABLE COMPOSITION COMPRISING AN URETHANE OLIGOMER HAVING A POLYESTER BACKBONE DSM IP ASSETS BV (NL) 2006-01-25 EP disclosed
US-6391936-B1 ACRYLATE POLYURETHANE POLYMER DSM N.V. (NL) 2002-05-21 US disclosed
US-6023547-A RIBBONS OF COATED OPTICAL FIBERS DSM N.V. (NL) 2000-02-08 US disclosed
EP-0924274-A2 Radiation-curable oligomers radiation-curable compositions, coated optical glass fibers, and ribbon assemblies DSM N.V. (NL) 1999-06-23 EP disclosed