SCHEMBL29959620

SCHEMBL29959620

CCCCCCCCC1([Zr]C2(CCCCCCCC)C=CC=C2)C=CC=C1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.36
THRB P10828 1/20 0.36
APAF1 O14727 1/20 0.34
HSP90AA1 P07900 1/20 0.34
RAD52 P43351 1/20 0.34
DNM1 Q05193 5/20 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
SCHEMBL30022268 0.91
SCHEMBL29523314 0.88
SCHEMBL29573822 0.80
Hydrochloric Acid SCHEMBL31695901 0.71 TSHR (0.35) TSHRTHRBAPAF1HSP90AA1RAD52
SCHEMBL30355003 0.70 TSHR (0.38) TSHRTHRBAPAF1HSP90AA1RAD52
Hexadecane SCHEMBL3183776 0.64 TSHR (0.89) TSHRTHRBDNM1
Heptane SCHEMBL3417507 0.64 TSHR (0.89) TSHRTHRBDNM1
Water SCHEMBL4410904 0.64 TSHR (0.89) TSHRTHRBDNM1
Octane SCHEMBL9716479 0.64 TSHR (0.89) TSHRTHRBDNM1
Octane SCHEMBL9716483 0.64 TSHR (0.89) TSHRTHRBDNM1

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
EP-4065277-A1 SYSTEMS AND METHODS FOR PRODUCING A SUPPORTED CATALYST ExxonMobil Chemical Patents Inc. (US) 2022-10-05 EP disclosed