SCHEMBL28672802

SCHEMBL28672802

CC1=Cc2c(cccc2-c2ccc(C(C)(C)C)cc2)[CH]1.[SiH3][Zr](Cl)Cl

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTAFR P25105 1/20 0.33
TSHR P16473 1/20 0.33
BRD4 O60885 1/20 0.30
CREBBP Q92793 1/20 0.30
NPC1 O15118 1/20 0.30
LMNA P02545 1/20 0.30
TP53 P04637 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL672592 0.92 TSHR (0.39) PTAFRTSHRBRD4CREBBPNPC1
SCHEMBL27689416 0.90 TSHR (0.38) PTAFRTSHRBRD4CREBBPNPC1
SCHEMBL21121017 0.89 TSHR (0.35) PTAFRTSHRBRD4CREBBPNPC1
SCHEMBL28938380 0.89 TSHR (0.35) PTAFRTSHRBRD4CREBBPNPC1
SCHEMBL1241864 0.79 RXRB (0.36) PTAFRTSHRNPC1RAB9A
SCHEMBL27446803 0.79 KIF11 (0.39) NPC1TP53RAB9ASMN1; SMN2
SCHEMBL7624416 0.77 ADORA3 (0.38) PTAFRNPC1RAB9ASMN1; SMN2
SCHEMBL27687633 0.77 KIF11 (0.38) NPC1TP53RAB9ASMN1; SMN2
SCHEMBL28860851 0.77 RXRB (0.35) PTAFR
SCHEMBL28198733 0.77 RXRB (0.35) PTAFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113614119-B Hybrid supported metallocene catalyst and method for preparing polypropylene using the same 株式会社LG化学 2023-04-11 CN disclosed
CN-113614119-A Hybrid supported metallocene catalyst and method for preparing polypropylene using the same 株式会社LG化学 2021-11-05 CN disclosed