SCHEMBL3124533

SCHEMBL3124533

c1ccc(Oc2ccccc2C[SiH]2CCCCO2)cc1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 11/20 0.45
SLC6A2 P23975 7/20 0.45
HRH1 P35367 1/20 0.43
RIPK1 Q13546 1/20 0.42
HTR2A P28223 5/20 0.37
SLC6A3 Q01959 6/20 0.36
CYP19A1 P11511 1/20 0.36
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
KMT2A Q03164 1/20 0.35
KDM1A O60341 2/20 0.35
KCNH2 Q12809 1/20 0.34
FAAH O00519 1/20 0.34
TSPO P30536 1/20 0.33

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
SCHEMBL5016152 0.74 HSPA5 (0.39) GAA
SCHEMBL16684619 0.74 CYP2A13 (0.39) LMNAKMT2A
SCHEMBL22361111 0.74 IDO1 (0.33)
SCHEMBL8837414 0.74 CYP2A13 (0.39) KMT2AKCNH2
SCHEMBL27916418 0.72 KCNA3 (0.41) KCNH2
SCHEMBL8184594 0.72
SCHEMBL4442660 0.72 NR1H2 (0.36) SLC6A4SLC6A2HRH1RIPK1SLC6A3
Ammonia Solution, Strong SCHEMBL7101819 0.72 CALM1 (0.30)
Ammonia Solution, Strong SCHEMBL278240 0.72 CALM1 (0.30)
SCHEMBL3119376 0.71 CHRNA7 (0.46) SLC6A4SLC6A2SLC6A3LMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1927636-B1 Aryl(thio)ether aryl polysiloxane composition and methods for making and using same ROHM & HAAS (US) 2010-02-10 EP disclosed
US-20080160323-A1 Hydrosilation catalysts; for encapsulating semiconductors U.S. BANK TRUST COMPANY, NATIONAL ASSOCIATION, AS NOTES COLLATERAL AGENT 2008-07-03 US disclosed
EP-1927636-A1 Aryl(thio)ether aryl polysiloxane composition and methods for making and using same Rohm and Haas Company (US) 2008-06-04 EP disclosed