SCHEMBL8380975

SCHEMBL8380975

C[Zr](C)(=C(c1ccccc1)c1ccccc1)(c1cccc2c1Cc1ccccc1-2)C1C=Cc2ccccc21

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
PNMT P11086 1/20 0.31

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
SCHEMBL814538 0.88 PNMT (0.32) NPC1RAB9APNMT
SCHEMBL8384440 0.88 NPC1 (0.37) NPC1RAB9APNMT
SCHEMBL2801806 0.81 NPC1 (0.37) NPC1RAB9APNMT
Hydrochloric Acid SCHEMBL812025 0.80 PNMT (0.33) NPC1RAB9APNMT
SCHEMBL8380325 0.79 PNMT (0.33) NPC1RAB9APNMT
SCHEMBL8381163 0.78 PNMT (0.31) NPC1RAB9APNMT
Hydrochloric Acid SCHEMBL6445783 0.76 PNMT (0.31) NPC1RAB9APNMT
SCHEMBL7716230 0.76 PNMT (0.34) NPC1RAB9APNMT
Hydrochloric Acid SCHEMBL8754977 0.76 PNMT (0.32) PNMT
Hydrochloric Acid SCHEMBL7076115 0.76 PNMT (0.32) NPC1RAB9APNMT

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
US-5916982-A Process for the production of polyolefins NIPPON OIL CO., LTD. (JP) 1999-06-29 US disclosed
EP-0768320-A1 Catalyst component and catalyst NIPPON OIL CO. LTD. (JP) 1997-04-16 EP disclosed
EP-0768319-A1 Process for the production of polyolefins NIPPON OIL CO. LTD. (JP) 1997-04-16 EP disclosed