SCHEMBL9745648

SCHEMBL9745648

CC(C)[Sn](Cl)(c1ccccc1)c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.33
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TSHR P16473 3/20 0.32
TAAR1 Q96RJ0 4/20 0.31
SLC6A2 P23975 2/20 0.31
MAOA P21397 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 1/20 0.31
SIGMAR1 Q99720 1/20 0.31
CYP2A6 P11509 1/20 0.31
ADORA2A P29274 1/20 0.31
ADORA1 P30542 1/20 0.31
LMNA P02545 1/20 0.30
ALOX12 P18054 1/20 0.30
ACHE P22303 1/20 0.30
HTR2A P28223 2/20 0.30
AOC3 Q16853 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
SCHEMBL9746177 0.79 TDP1 (0.33) TDP1KDM4EALDH1A1TSHRTAAR1
SCHEMBL29819752 0.79 TDP1 (0.33) TDP1KDM4EALDH1A1TSHRTAAR1
SCHEMBL9746483 0.77 TDP1 (0.32) TDP1KDM4EALDH1A1TSHRTAAR1
SCHEMBL1452401 0.72 TDP1 (0.36) TDP1KDM4EALDH1A1TSHRTAAR1
SCHEMBL25291459 0.72 TDP1 (0.36) TDP1KDM4EALDH1A1TSHRTAAR1
SCHEMBL9746053 0.72 TP53 (0.32) TAAR1SLC6A2MAOASLC6A4SLC6A3
SCHEMBL9746333 0.72 RIPK1 (0.31)
SCHEMBL6908951 0.69 TSHR (0.37) ALDH1A1TSHRCYP2A6LMNAALOX12
SCHEMBL8147062 0.69 TSHR (0.37) ALDH1A1TSHRCYP2A6LMNAALOX12
SCHEMBL9746401 0.69 TSHR (0.37) ALDH1A1TSHRCYP2A6LMNAALOX12

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-5100762-A Radiation-sensitive polymer and radiation-sensitive composition containing the same MITSUBISHI DENKI KABUSHIKI KAISHA (JP) 1992-03-31 US disclosed