SCHEMBL8750713

SCHEMBL8750713

CC=[Ti](c1cccc2c1Cc1ccccc1-2)C1C=Cc2ccccc21

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL8750711 1.00 PNMT (0.33) PNMTNPC1RAB9A
SCHEMBL7035055 0.93 PNMT (0.32) PNMT
SCHEMBL8166075 0.82 PNMT (0.37) PNMTNPC1RAB9A
SCHEMBL8750696 0.81 PNMT (0.35) PNMTNPC1RAB9A
SCHEMBL7109330 0.81 PNMT (0.33) PNMTNPC1RAB9A
SCHEMBL7635262 0.76 PNMT (0.34) PNMT
SCHEMBL7027338 0.75 PNMT (0.33) PNMTRAB9A
SCHEMBL7029455 0.75 PNMT (0.32) PNMT
SCHEMBL5823610 0.71 PNMT (0.41) PNMTNPC1RAB9A
SCHEMBL7924372 0.68 PNMT (0.35) PNMTNPC1RAB9A

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-0591841-B1 Process for producing styrenic polymer IDEMITSU KOSAN CO (JP) 1997-04-09 EP disclosed
EP-0742233-A1 METHOD OF CONTROLLING MOLECULAR WEIGHT OF STYRENIC POLYMER IDEMITSU KOSAN COMPANY LIMITED (JP) 1996-11-13 EP disclosed
EP-0584646-A2 Process for producing styrenic polymer IDEMITSU PETROCHEMICAL CO., LTD. (JP) 1994-03-02 EP disclosed