SCHEMBL8393085

SCHEMBL8393085

C1=CC([Hf]([SiH2]Cc2ccccc2)C2C=Cc3ccccc32)c2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 6/20 0.38
HTR6 P50406 1/20 0.37
HTR2A P28223 1/20 0.34

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 SCHEMBL8852068 0.98 SIGMAR1 (0.37) SIGMAR1HTR6HTR2A
Hydrochloric Acid SCHEMBL7715906 0.74 HTR2A (0.33) SIGMAR1HTR6HTR2A
SCHEMBL7026621 0.72 SIGMAR1 (0.37) SIGMAR1HTR6HTR2A
Hydrochloric Acid SCHEMBL8853869 0.71 SIGMAR1 (0.36) SIGMAR1HTR6HTR2A
Hydrochloric Acid SCHEMBL7638072 0.71 SIGMAR1 (0.36) SIGMAR1HTR6HTR2A
SCHEMBL8559397 0.71 HTR6 (0.33) SIGMAR1HTR6HTR2A
SCHEMBL9440641 0.69 HTR2A (0.35) SIGMAR1HTR6HTR2A
Hydrochloric Acid SCHEMBL5861383 0.69 SIGMAR1 (0.37) SIGMAR1HTR6HTR2A
SCHEMBL7612938 0.69 HTR6 (0.41) SIGMAR1HTR6HTR2A
SCHEMBL3998874 0.69 HTR2A (0.38) SIGMAR1HTR6HTR2A

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
EP-1597632-B1 NON-MAGNETIC MONOCOMPONENT POSITIVE TONER COMPOSITION HAVING SUPERIOR TRANSFER EFFICIENCY LG CHEMICAL LTD (KR) 2013-03-27 EP claimed
US-5866662-A HAS AT ONE OR BOTH ENDS AN OLEFINICALLY UNSATURATED GROUP HAVING AT LEAST 3 CARBON ATOMS. HOECHST AKTIENGESELLSCHAFT (DE) 1999-02-02 US disclosed