SCHEMBL14729136

SCHEMBL14729136

Cc1cc(C)cc(C(C)(C)c2cc(C)c(O)c(C)c2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.48
ALOX15 P16050 3/20 0.48
HIF1A Q16665 3/20 0.48
HSD17B10 Q99714 3/20 0.48
ALOX12 P18054 2/20 0.48
CYP3A4 P08684 2/20 0.48
HPGD P15428 2/20 0.48
TSHR P16473 2/20 0.48
CASP1 P29466 1/20 0.48
RECQL P46063 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
ESR1 P03372 3/20 0.46
ESR2 Q92731 2/20 0.46
CA2 P00918 2/20 0.46
CA1 P00915 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.44
POLB P06746 1/20 0.44
TYR P14679 1/20 0.44
GAA P10253 2/20 0.43
KDM4E B2RXH2 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
SCHEMBL69586 0.90 ALDH1A1 (0.56) ALDH1A1ALOX15HIF1AHSD17B10ALOX12
SCHEMBL29472991 0.87 ALDH1A1 (0.54) ALDH1A1ALOX15HIF1AHSD17B10ALOX12
SCHEMBL2618674 0.87 ALDH1A1 (0.54) ALDH1A1ALOX15HIF1AHSD17B10ALOX12
SCHEMBL2452837 0.84 ALDH1A1 (0.42) ALDH1A1ALOX15HIF1AHSD17B10ALOX12
SCHEMBL28468013 0.83 ESR1 (0.48) ALDH1A1HIF1AHSD17B10CYP3A4ESR1
SCHEMBL686758 0.83 ESR1 (0.60) ALDH1A1ALOX15HIF1AHSD17B10ALOX12
SCHEMBL18311965 0.83 ALDH1A1 (0.50) ALDH1A1ALOX15HIF1AHSD17B10ALOX12
SCHEMBL10882653 0.82 SHBG (0.53) ALDH1A1ALOX15HIF1AHSD17B10ALOX12
SCHEMBL2754942 0.80 ALOX15 (0.50) ALDH1A1ALOX15HIF1AHSD17B10ALOX12
SCHEMBL14186008 0.80 PTPN1 (0.50) ALDH1A1ALOX15HIF1AHSD17B10ALOX12

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
EP-3386938-B1 METHOD OF BISPHENOL MANUFACTURE SABIC GLOBAL TECHNOLOGIES BV (NL) 2020-10-07 EP disclosed
US-20170260333-A1 POLYETHERIMIDE COMPOSITIONS AND METHODS FOR THE MANUFACTURE AND USE THEREOF SHPP GLOBAL TECHNOLOGIES B.V. (NL) 2017-09-14 US disclosed
WO-2017100164-A1 METHOD OF BISPHENOL MANUFACTURE SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2017-06-15 WO disclosed
US-20150133625-A1 POLYETHERIMIDE COMPOSITIONS AND METHODS FOR THE MANUFACTURE AND USE THEREOF SHPP GLOBAL TECHNOLOGIES B.V. (NL) 2015-05-14 US disclosed
US-20130053489-A1 POLYETHERIMIDE COMPOSITIONS AND METHODS FOR THE MANUFACTURE AND USE THEREOF SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2013-02-28 US disclosed