SCHEMBL9746349

SCHEMBL9746349

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

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 1/20 0.32
TP53 P04637 1/20 0.32
SIGMAR1 Q99720 2/20 0.31
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
LMNA P02545 1/20 0.31
CYP2A6 P11509 1/20 0.31
ADORA2A P29274 1/20 0.31
ADORA1 P30542 1/20 0.31
TRPA1 O75762 1/20 0.31
CYP19A1 P11511 1/20 0.31
ATM Q13315 1/20 0.30
ESR1 P03372 1/20 0.30
ESR2 Q92731 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
SCHEMBL2271815 0.83 SMN1; SMN2 (0.32) AOC3TP53SIGMAR1
SCHEMBL6036794 0.74 RIPK1 (0.32)
SCHEMBL28291480 0.73 TP53 (0.35) TP53SIGMAR1TAAR1SLC6A2MAOA
SCHEMBL705725 0.72 ESR1 (0.34) AOC3SIGMAR1TAAR1SLC6A2MAOA
SCHEMBL703207 0.72 TP53 (0.38) TP53LMNACYP19A1ATMESR1
SCHEMBL115193 0.72 TP53 (0.38) TP53LMNACYP19A1ATMESR1
SCHEMBL705425 0.72 ESR1 (0.34) AOC3SIGMAR1TAAR1SLC6A2MAOA
SCHEMBL705504 0.72 TP53 (0.38) TP53LMNATRPA1CYP19A1ATM
SCHEMBL706818 0.72 MAOA (0.36) AOC3SIGMAR1TAAR1SLC6A2MAOA
SCHEMBL9746360 0.71 TP53 (0.33) TP53TAAR1SLC6A2LMNAESR1

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