SCHEMBL29907869

SCHEMBL29907869

CC(C)[Hf](c1cccc2c1Cc1ccccc1-2)C1C=CC=C1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.43
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
HTR2B P41595 2/20 0.33
HTR7 P34969 1/20 0.33
PGR P06401 1/20 0.32
CYP1A2 P05177 2/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
HSD17B10 Q99714 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA4 P22748 1/20 0.30
CA6 P23280 1/20 0.30
DRD2 P14416 1/20 0.30
DRD4 P21917 1/20 0.30
DRD3 P35462 1/20 0.30
MAOA P21397 2/20 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
SCHEMBL30798903 0.78 PNMT (0.39) PNMTNPC1RAB9AHTR2BHTR7
SCHEMBL29459327 0.78 NPC1 (0.43) PNMTNPC1RAB9AHTR2BHTR7
SCHEMBL29700197 0.77 PNMT (0.36) PNMTNPC1RAB9AHTR2BHTR7
SCHEMBL29459211 0.75 NPC1 (0.41) PNMTNPC1RAB9AHTR2BHTR7
SCHEMBL29775014 0.73 PNMT (0.37) PNMTNPC1RAB9AHTR2BHTR7
SCHEMBL29907928 0.72 PNMT (0.37) PNMTNPC1RAB9A
SCHEMBL6142450 0.72 PNMT (0.50) PNMTNPC1RAB9AHTR2BHTR7
SCHEMBL27447175 0.72 PNMT (0.41) PNMTNPC1RAB9AHTR2BHTR7
SCHEMBL7156887 0.70 PNMT (0.37) PNMTNPC1RAB9AHTR2BHTR7
SCHEMBL524602 0.69 PNMT (0.63) PNMTNPC1RAB9AHTR2BHTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3827033-B1 PREPARATION OF BIMODAL RUBBER, THERMOPLASTIC VULCANIZATES, AND ARTICLES MADE THEREFROM EXXONMOBIL CHEMICAL PATENTS INC (US) 2025-01-01 EP disclosed
CN-112703210-B Preparation of bimodal rubbers, thermoplastic vulcanizates, and articles made therefrom 埃克森美孚化学专利公司 2022-10-28 CN disclosed
US-11466149-B2 Preparation of bimodal rubber, thermoplastic vulcanizates, and articles made therefrom EXXONMOBIL CHEMICAL PATENTS INC. (US) 2022-10-11 US disclosed