SCHEMBL21291846

SCHEMBL21291846

CC(C)(C)c1ccc(C2=CC=CC2[Zr](Cl)(Cl)(=C(c2ccccc2)c2ccccc2)C2c3ccccc3-c3ccccc32)cc1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
FFAR2 O15552 1/20 0.31
KCNK9 Q9NPC2 1/20 0.30

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
SCHEMBL21291831 0.91 RXRA (0.35)
SCHEMBL21291820 0.87 HSP90AA1 (0.32)
SCHEMBL21291841 0.86
SCHEMBL21291849 0.79 TYMS (0.31)
SCHEMBL20440912 0.78
SCHEMBL21291828 0.78
SCHEMBL20440914 0.77
SCHEMBL21291837 0.77 EPHX1 (0.32) ALDH1A1
SCHEMBL21291838 0.75 HSP90AA1 (0.32) ALDH1A1RAB9A
SCHEMBL2872427 0.72 NPC1 (0.31) NPC1ALDH1A1RAB9A

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
EP-3239196-B1 MULTIMODAL POLYOLEFIN RESIN HAVING HIGH MELT STRENGTH AND MOLDED PRODUCT PREPARED WITH THE SAME DAELIM IND CO LTD (KR) 2019-08-28 EP disclosed