SCHEMBL7937688

SCHEMBL7937688

[H-].[H-].[Zr+2]c1cccc2c1Cc1ccccc1-2

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.52
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
HTR7 P34969 2/20 0.41
HTR2B P41595 2/20 0.41
DRD2 P14416 2/20 0.40
DRD4 P21917 1/20 0.40
DRD3 P35462 1/20 0.40
MAOA P21397 1/20 0.40
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA4 P22748 1/20 0.39
CA6 P23280 1/20 0.39
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
BCHE P06276 2/20 0.38

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
Hydrochloric Acid SCHEMBL29556732 0.96 PNMT (0.52) PNMTNPC1RAB9AHTR7HTR2B
Hydrochloric Acid SCHEMBL540483 0.96 PNMT (0.52) PNMTNPC1RAB9AHTR7HTR2B
Hydrochloric Acid SCHEMBL28634670 0.86 PNMT (0.44) PNMTNPC1RAB9AHTR7HTR2B
SCHEMBL524602 0.82 PNMT (0.63) PNMTNPC1RAB9AHTR7HTR2B
SCHEMBL30103334 0.82 PNMT (0.63) PNMTNPC1RAB9AHTR7HTR2B
SCHEMBL2877998 0.80 PNMT (0.61) PNMTNPC1RAB9AHTR7HTR2B
Hydrochloric Acid SCHEMBL9861299 0.78 PNMT (0.38) PNMTNPC1RAB9AHTR7HTR2B
Hydrochloric Acid SCHEMBL4832744 0.77 PNMT (0.42) PNMTNPC1RAB9AHTR7HTR2B
SCHEMBL22263591 0.77 PNMT (0.57) PNMTNPC1RAB9AHTR7HTR2B
SCHEMBL2573139 0.77 PNMT (0.53) PNMTNPC1RAB9AHTR7HTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1302022-C Matrix for producing poly olefine and method ROHM & HAAS (US) 2007-02-28 CN disclosed
CN-1339508-A Matrix for producing poly olefine and method ROHM & HAAS (US) 2002-03-13 CN disclosed
US-6245706-B1 GROUP-4 METALLOCENE STABILIZED WITH AN ANIONIC POLYNUCLEAR BORON COMPOUND FOR IMPROVED POLYMER MOLECULAR WEIGHT CONTROL AND NARROW MOLECULAR WEIGHT DISTRIBUTION EXXON CHEMICAL PATENTS, INC. 2001-06-12 US disclosed
US-5599761-A Ionic metallocene catalyst compositions EXXON CHEMICAL PATENTS, INC. (US) 1997-02-04 US disclosed
US-5470927-A Ionic metallocene catalyst compositions EXXON CHEMICAL PATENTS INC. (US) 1995-11-28 US disclosed
EP-0513216-A1 BLOCK COPOLYMERS FROM IONIC CATALYSTS. EXXON CHEMICAL PATENTS INC (US) 1992-11-19 EP disclosed