SCHEMBL416584

SCHEMBL416584

CC[Si](c1ccccc1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.41
PSIP1 O75475 1/20 0.35
LMNA P02545 2/20 0.33
TSHR P16473 2/20 0.33
ALOX12 P18054 1/20 0.33
ACHE P22303 1/20 0.33
TRPA1 O75762 1/20 0.32
ATM Q13315 1/20 0.32
KCNN4 O15554 1/20 0.32
CALM1 P0DP23 1/20 0.32
CES1 P23141 2/20 0.31
CES2 O00748 1/20 0.31
LTA4H P09960 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
THRB P10828 1/20 0.31
IDO1 P14902 1/20 0.31
ALDH1A1 P00352 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
CYP3A4 P08684 1/20 0.31

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
SCHEMBL415334 0.78 TP53 (0.38) TP53PSIP1LMNATSHRALOX12
SCHEMBL80926 0.77 TP53 (0.41) TP53PSIP1LMNATSHRALOX12
SCHEMBL7640554 0.77 CALM1 (0.32) CALM1ALDH1A1MAPT
Fluoride SCHEMBL27660696 0.76 TP53 (0.36) TP53PSIP1LMNACES1CES2
SCHEMBL2229738 0.74 TP53 (0.39) TP53PSIP1LMNATSHRALOX12
Fluoride SCHEMBL27660898 0.74 TP53 (0.39) TP53PSIP1LMNATSHRALOX12
SCHEMBL114778 0.74 LTA4H (0.38) TP53TSHRCES1CES2LTA4H
SCHEMBL416284 0.72 LTA4H (0.38) TP53CES1CES2LTA4HSMN1; SMN2
Hydrochloric Acid SCHEMBL27842651 0.72 LTA4H (0.36) TP53TSHRCES1CES2LTA4H
SCHEMBL19200696 0.72 TP53 (0.38) TP53PSIP1LMNATSHRTRPA1

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 976 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023070009-A1 SILYL ETHER DERIVATIVES OF POLYETHER POLYMERS P2 SCIENCE, INC. (US) 2023-04-27 WO claimed
EP-3998304-A2 ORGANIC SEMICONDUCTOR COMPOSITIONS SmartKem Limited (GB) 2022-05-18 EP claimed
EP-2817355-B1 ORGANIC SEMICONDUCTOR COMPOSITIONS SMARTKEM LTD (GB) 2021-03-24 EP claimed
EP-2817356-B1 ORGANIC SEMICONDUCTOR COMPOSITIONS SMARTKEM LTD (GB) 2021-02-17 EP claimed
EP-2817354-B1 ORGANIC SEMICONDUCTOR COMPOSITIONS SMARTKEM LTD (GB) 2021-01-13 EP claimed
EP-2817357-B1 ORGANIC SEMICONDUCTOR COMPOSITIONS SMARTKEM LTD (GB) 2020-11-04 EP claimed
EP-2817351-B1 ORGANIC SEMICONDUCTOR COMPOSITIONS SMARTKEM LTD (GB) 2020-08-26 EP claimed
EP-2817352-B1 ORGANIC SEMICONDUCTOR COMPOSITIONS SMARTKEM LTD (GB) 2020-08-26 EP claimed
US-10707420-B2 Polycyclic aromatic hydrocarbon copolymer-containing organic semiconductor compositions SMARTKEM LIMITED (GB) 2020-07-07 US claimed
US-10056550-B2 Polycyclic aromatic hydrocarbon copolymers and their use as organic semiconductors SMARTKEM LIMITED (GB) 2018-08-21 US claimed
US-RE39072-E1 2-aminopropane-1,3-diol compounds, medicinal use thereof, and intermediates in synthesizing the same MITSUBISHI PHARMA CORPORATION (JP) 2006-04-18 US claimed
EP-1002792-B1 2-AMINOPROPANE-1,3-DIOL COMPOUNDS, MEDICINAL USE THEREOF, AND INTERMEDIATES IN SYNTHESIZING THE SAME MITSUBISHI PHARMA CORP (JP) 2004-07-14 EP claimed
US-6214873-B1 PREVENTION OR SUPPRESION OF REJECTION OF ORGANS OR BONE MARROW TRANSPLANTATION; TREATMENT OF AUTOIMMUNE DISEASES OR ALLERGIC DISEASES; DECREASE IN TOXICITY AND HIGHER SAFETY WELFIDE CORPORATION (JP) 2001-04-10 US claimed
US-5756707-A REACTING A PARTIALLY PROTECTED CYTOSINE RIBONUCLEOSIDE WITH A HYDROCARBON HALIDE IN THE PRESENCE OF A METAL SALT CATALYST AND A BASE PERSEPTIVE BIOSYSTEMS, INC. (US) 1998-05-26 US claimed
WO-1996018638-A2 2'-O-DERIVATIZED PYRIMIDINE RIBONUCLEOSIDES AND METHODS OF PRODUCTION PERSEPTIVE BIOSYSTEMS, INC. (US) 1996-06-20 WO claimed
US-5516871-A Diphenylsiloxane oligomers functionalized at both terminals and methods for the preparation thereof DOW CORNING ASIA, LTD. (JP) 1996-05-14 US claimed
US-5502229-A ENDCAPPING DOW CORNING ASIA, LTD. (JP) 1996-03-26 US claimed
EP-0690856-A4 UNIV NEW YORK (US) 1996-02-07 EP claimed
EP-0690856-A1 ANTI-TUMOR COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, METHODS FOR PREPARATION THEREOF AND FOR TREATMENT THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 1996-01-10 EP claimed
WO-1994022856-A1 ANTI-TUMOR COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, METHODS FOR PREPARATION THEREOF AND FOR TREATMENT THE RESEARCH FOUNDATION OF THE STATE UNIVERSITY OF NEW YORK (US) 1994-10-13 WO claimed