SCHEMBL9745630

SCHEMBL9745630

CC[Sn](O)(CC)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.38
LMNA P02545 3/20 0.36
ATM Q13315 1/20 0.34
TRPA1 O75762 1/20 0.34
CES2 O00748 2/20 0.33
CES1 P23141 2/20 0.33
TSHR P16473 4/20 0.32
GLA P06280 2/20 0.32
ALDH1A1 P00352 1/20 0.32
PSIP1 O75475 1/20 0.32
CA4 P22748 2/20 0.32
HPGD P15428 1/20 0.31
PCSK9 Q8NBP7 1/20 0.31
MAPT P10636 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA3 P07451 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
SCHEMBL9745597 0.86 TP53 (0.32) TP53LMNAATMTRPA1CES2
SCHEMBL9746121 0.83 PCSK9 (0.37) LMNACES2CES1PCSK9
SCHEMBL9746510 0.82 TP53 (0.36) TP53LMNAATMTRPA1CES2
SCHEMBL9746784 0.79 TP53 (0.38) TP53LMNAATMCES2CES1
SCHEMBL9746969 0.77 TP53 (0.36) TP53LMNAATMCES2CES1
SCHEMBL11254087 0.75 TP53 (0.35) TP53LMNAATMCES2CES1
SCHEMBL25355509 0.72 TP53 (0.48) TP53LMNAATMCES2CES1
SCHEMBL1031778 0.72 TP53 (0.41) TP53LMNAATMCES2CES1
SCHEMBL898908 0.72 TP53 (0.48) TP53LMNAATMCES2CES1
SCHEMBL1029950 0.72 TP53 (0.41) TP53LMNAATMCES2CES1

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