SCHEMBL6908951

SCHEMBL6908951

C[Sn](C)(Cl)c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.37
LMNA P02545 2/20 0.37
ACHE P22303 2/20 0.35
ALOX12 P18054 1/20 0.35
ALDH1A1 P00352 3/20 0.32
TP53 P04637 1/20 0.30
BBOX1 O75936 1/20 0.30
EHMT2 Q96KQ7 1/20 0.30
EHMT1 Q9H9B1 1/20 0.30
MAOB P27338 1/20 0.30
CA4 P22748 1/20 0.30
CYP2A6 P11509 1/20 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
SCHEMBL8147062 0.81 TSHR (0.37) TSHRLMNAACHEALOX12ALDH1A1
SCHEMBL9746401 0.81 TSHR (0.37) TSHRLMNAACHEALOX12ALDH1A1
SCHEMBL6008833 0.79 TSHR (0.35) TSHRLMNAACHEALOX12ALDH1A1
SCHEMBL444720 0.73 TSHR (0.39) TSHRLMNAACHEALOX12ALDH1A1
SCHEMBL67729 0.73 TSHR (0.39) TSHRLMNAACHEALOX12ALDH1A1
SCHEMBL130651 0.73 TSHR (0.39) TSHRLMNAACHEALOX12ALDH1A1
SCHEMBL352235 0.73 TSHR (0.39) TSHRLMNAACHEALOX12ALDH1A1
SCHEMBL28829375 0.73 TSHR (0.39) TSHRLMNAACHEALOX12ALDH1A1
SCHEMBL1026637 0.73 TSHR (0.39) TSHRLMNAACHEALOX12ALDH1A1
SCHEMBL151842 0.73 TSHR (0.39) TSHRLMNAACHEALOX12ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6696611-B2 Chemical methods CHIROGEN PTY. LIMITED (AU) 2004-02-24 US disclosed
US-5100762-A Radiation-sensitive polymer and radiation-sensitive composition containing the same MITSUBISHI DENKI KABUSHIKI KAISHA (JP) 1992-03-31 US disclosed
US-5008417-A Haloalkylation process ETHYL CORPORATION (US) 1991-04-16 US disclosed
US-4130432-A BIOCIDES CIBA-GEIGY CORPORATION (US) 1978-12-19 US disclosed