SCHEMBL24119613

SCHEMBL24119613

CC(C)COc1ccc(C(C)(C)c2ccc(O)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.55
AR P10275 3/20 0.55
ESR1 P03372 3/20 0.55
ESR2 Q92731 3/20 0.55
TSHR P16473 3/20 0.55
CYP3A4 P08684 2/20 0.55
SLC6A2 P23975 2/20 0.55
SLC6A4 P31645 1/20 0.55
HTR6 P50406 1/20 0.55
ESRRG P62508 1/20 0.55
SLC6A3 Q01959 1/20 0.55
HSD17B10 Q99714 1/20 0.55
HIF1A Q16665 2/20 0.53
HTT P42858 1/20 0.53
ALDH1A1 P00352 4/20 0.48
PTGS1 P23219 1/20 0.47
KMT2A Q03164 2/20 0.44
MAPT P10636 3/20 0.43
POLB P06746 1/20 0.43
XBP1 P17861 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
SCHEMBL24498793 0.91 HIF1A (0.56) HPGDARTSHRHSD17B10HIF1A
SCHEMBL823191 0.88 HIF1A (0.55) HPGDARESR1ESR2TSHR
SCHEMBL13892365 0.88 HIF1A (0.55) HPGDARESR1ESR2TSHR
SCHEMBL3173896 0.87 SLC6A2 (0.58) HPGDSLC6A2SLC6A4SLC6A3HIF1A
SCHEMBL5891242 0.87 AR (0.52) HPGDARESR1ESR2TSHR
SCHEMBL17702714 0.86 HIF1A (0.56) HPGDARTSHRHIF1AHTT
SCHEMBL16553424 0.86 HIF1A (0.56) HPGDARESR1ESR2TSHR
SCHEMBL13567688 0.86 HTT (0.65) HPGDARESR1ESR2TSHR
SCHEMBL19531152 0.86 HTT (0.57) HPGDARESR1ESR2TSHR
SCHEMBL8760897 0.85 SLC6A2 (0.44) HPGDARESR1ESR2TSHR

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-20210395603-A1 PROPPANT COATINGS AND METHODS OF MAKING SAUDI ARABIAN OIL COMPANY (SA) 2021-12-23 US disclosed