SCHEMBL19953377

SCHEMBL19953377

CC(C)(C)c1ccc2c(c1)-c1cc(C(C)(C)C)ccc1C2C(C)(c1ccccc1)C1C=CC=C1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
NPC1 O15118 1/20 0.38
PLA2G1B P04054 1/20 0.38
NFKB1 P19838 1/20 0.38
CASP3 P42574 1/20 0.38
RAB9A P51151 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ATG4B Q9Y4P1 1/20 0.38
CYP19A1 P11511 1/20 0.34
HDAC4 P56524 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
RXRA P19793 1/20 0.31
RXRB P28702 1/20 0.31
KIF11 P52732 3/20 0.31

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
SCHEMBL23780937 0.94 ALDH1A1 (0.35) ALDH1A1NPC1PLA2G1BNFKB1CASP3
SCHEMBL23780942 0.93 ALDH1A1 (0.36) ALDH1A1NPC1PLA2G1BNFKB1CASP3
SCHEMBL27224619 0.88 ALDH1A1 (0.38) ALDH1A1NPC1PLA2G1BNFKB1CASP3
SCHEMBL27544369 0.80 ALDH1A1 (0.36) ALDH1A1NPC1PLA2G1BNFKB1CASP3
SCHEMBL26988456 0.73 ALDH1A1 (0.38) ALDH1A1NPC1PLA2G1BNFKB1CASP3
SCHEMBL38651760 0.73 ALDH1A1 (0.38) ALDH1A1NPC1PLA2G1BNFKB1CASP3
SCHEMBL23272671 0.70 ALDH1A1 (0.37) ALDH1A1NPC1RAB9AL3MBTL1CYP2C19
SCHEMBL5006653 0.70 NPC1 (0.35) ALDH1A1NPC1PLA2G1BNFKB1CASP3
SCHEMBL38651494 0.67 ALDH1A1 (0.36) ALDH1A1NPC1PLA2G1BNFKB1CASP3
SCHEMBL1480699 0.67 ALDH1A1 (0.45) ALDH1A1NPC1PLA2G1BNFKB1CASP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210317238-A1 Bis(Metallocene) Compounds and Catalyst Compositions Employing Such Compounds CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2021-10-14 US disclosed
US-20210284767-A1 Process for Preparing Polyethylene TOTAL RESEARCH & TECHNOLOGY FELUY (BE) 2021-09-16 US disclosed
US-20210277155-A1 Process for Preparing Polypropylene TOTAL RESEARCH & TECHNOLOGY FELUY (BE) 2021-09-09 US disclosed
EP-3510060-A1 PROCESS FOR PREPARING POLYPROPYLENE Total Research & Technology Feluy (BE) 2019-07-17 EP disclosed
EP-3510037-A1 BIS(METALLOCENE) COMPOUNDS AND CATALYST COMPOSITIONS EMPLOYING SUCH COMPOUNDS Total Research & Technology Feluy (BE) 2019-07-17 EP disclosed
EP-3510039-A1 PROCESS FOR PREPARING POLYETHYLENE Total Research & Technology Feluy (BE) 2019-07-17 EP disclosed
WO-2018046566-A1 BIS(METALLOCENE) COMPOUNDS AND CATALYST COMPOSITIONS EMPLOYING SUCH COMPOUNDS TOTAL RESEARCH & TECHNOLOGY FELUY (BE) 2018-03-15 WO disclosed
WO-2018046567-A1 PROCESS FOR PREPARING POLYETHYLENE TOTAL RESEARCH & TECHNOLOGY FELUY (BE) 2018-03-15 WO disclosed
WO-2018046568-A1 PROCESS FOR PREPARING POLYPROPYLENE TOTAL RESEARCH & TECHNOLOGY FELUY (BE) 2018-03-15 WO disclosed