Sugi Predict

Sugi Predict / Compounds / SCHEMBL7599008

SCHEMBL7599008

SCHEMBL7599008

CCC1=Cc2c(-c3cccc4ccccc34)cccc2C1[Zr](C)(C)[Si]1([Zr](C)(C)C2C(CC)=Cc3c(-c4cccc5ccccc45)cccc32)CCCC1

nearest known ligand 0.30

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ HTR7 P34969 2/20 0.30
▸ HTR1A P08908 1/20 0.30
▸ HTR2B P41595 1/20 0.30
▸ TMEM97 Q5BJF2 1/20 0.30
▸ SIGMAR1 Q99720 1/20 0.30
▸ SLC6A4 P31645 2/20 0.30
▸ DRD2 P14416 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
SCHEMBL7602869 0.85 — —
SCHEMBL7599710 0.85 MAOA (0.30) HTR7HTR1A
SCHEMBL796945 0.84 CNR2 (0.30) HTR7
SCHEMBL27473875 0.81 HTR7 (0.32) HTR7HTR1AHTR2BTMEM97SIGMAR1
SCHEMBL7599308 0.81 CNR2 (0.32) HTR7HTR1AHTR2BTMEM97SIGMAR1
SCHEMBL2522719 0.80 PTPN1 (0.33) HTR7HTR1AHTR2BTMEM97SIGMAR1
Propane SCHEMBL8633041 0.79 SLC6A4 (0.32) HTR7HTR1AHTR2BTMEM97SIGMAR1
Ethane SCHEMBL8632402 0.79 KDM4E (0.31) HTR7HTR1AHTR2BTMEM97SIGMAR1
SCHEMBL7607488 0.79 PPARG (0.31) HTR7HTR1AHTR2BTMEM97SIGMAR1
Hexane SCHEMBL8633532 0.76 TLR8 (0.36) HTR7SLC6A4DRD2

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
US-6410665-B1 POLYMERIZATION COORDINATION CATALYST FOR ALPHA-OLEFIN BASELL POLYOLEFINE GMBH (DE) 2002-06-25 — — US claimed
US-6410665-B1 POLYMERIZATION COORDINATION CATALYST FOR ALPHA-OLEFIN BASELL POLYOLEFINE GMBH (DE) 2002-06-25 — — US disclosed