SCHEMBL7936604

SCHEMBL7936604

CCC1=Cc2c(-c3cccc4ccccc34)cccc2C1[Hf](Cl)(Cl)(C1C(CC)=Cc2c(-c3cccc4ccccc34)cccc21)=[Si](C)C

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 4/20 0.32
SLC6A2 P23975 1/20 0.30
SLC6A3 Q01959 1/20 0.30
KDM4E B2RXH2 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
SCHEMBL20572964 0.85 SLC6A4 (0.31) SLC6A4
SCHEMBL6914199 0.84 ALDH1A1 (0.32) SLC6A4SLC6A2SLC6A3KDM4E
SCHEMBL7217385 0.84 CYP2A6 (0.30)
SCHEMBL7926522 0.83
SCHEMBL818623 0.83 ALOX15 (0.30)
SCHEMBL7935517 0.81 NPC1 (0.31)
Hydrochloric Acid SCHEMBL818624 0.81 HTR7 (0.31) SLC6A4
Hydrochloric Acid SCHEMBL7926525 0.81 HTR7 (0.31) SLC6A4
SCHEMBL16393655 0.80 HTR1A (0.32) SLC6A4SLC6A3
SCHEMBL5612569 0.79 KDM4E (0.32) SLC6A4SLC6A2SLC6A3KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6184402-B1 RESOLUTION OF A STEREOISOMERIC MIXTURE OF SPECIFIC METALLOCENE COMPLEXES BRIDGED WITH A TRANSITION METAL HAVING AN OXYGEN BOND ATTACHED, I.E., A MU-OXO COMPLEX; HYDROLYSIS IN THE PRESENCE OF A BASE; SEPARATION OF MESO FORM FROM MIXES CHISSO CORPORATION (JP) 2001-02-06 US disclosed