SCHEMBL8764198

SCHEMBL8764198

CC[Si](C#N)(c1ccccc1)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.33
TP53 P04637 1/20 0.33
MAPT P10636 1/20 0.33
CRHBP P24387 1/20 0.33
CRHR2 Q13324 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ADORA2A P29274 1/20 0.33
ADORA1 P30542 1/20 0.33
LMNA P02545 1/20 0.32
CTSK P43235 1/20 0.32
ALDH1A1 P00352 2/20 0.31
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31
CYP1A1 P04798 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP1B1 Q16678 1/20 0.31
GAA P10253 1/20 0.31
KDM4E B2RXH2 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
SCHEMBL10727315 0.77 TP53 (0.33) TSHRTP53LMNAALDH1A1ESR1
SCHEMBL988676 0.69 NR1H2 (0.43) TSHRTP53MAPTLMNAALDH1A1
SCHEMBL9632223 0.69 ESR1 (0.39) TSHRMAPTADORA2AADORA1ALDH1A1
SCHEMBL1456592 0.68 CTSK (0.33) TSHRTP53MAPTCRHBPCRHR2
SCHEMBL8763214 0.68 MAPT (0.31) TSHRTP53MAPTCRHBPCRHR2
SCHEMBL8763495 0.68 MAPT (0.31) TSHRTP53MAPTCRHBPCRHR2
SCHEMBL7524704 0.67 TSHR (0.41) TSHRADORA2AADORA1ALDH1A1ESR1
SCHEMBL3889977 0.67 TP53 (0.41) TSHRTP53MAPTLMNAALDH1A1
SCHEMBL2444645 0.67 ESR1 (0.56) TSHRTP53MAPTLMNAALDH1A1
SCHEMBL9226507 0.65 MAPT (0.45) TSHRTP53MAPTLMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0349195-B1 Direct synthesis by cationic polymerization of nitrogen-containing polymers EXXON CHEMICAL PATENTS INC (US) 1997-05-21 EP disclosed
US-5629394-A ENDCAPPING ADDITION POLYMERS WITH NITROGEN FUNCTIONAL GROUPS WHICH CAN BE FURTHER DERIVATIZED EXXON CHEMICAL PATENTS INC (US) 1997-05-13 US disclosed
US-5444135-A Polymerization and functionalization with nitrogen-containing functional groups occur simultaneously EXXON CHEMICAL PATENTS INC. (US) 1995-08-22 US disclosed
US-5336745-A Terminally-substituted polymeric compositions from cationically polymerizable monomers and initiators EXXON CHEMICAL PATENTS INC. (US) 1994-08-09 US disclosed
US-5032653-A Catalysts EXXON CHEMICAL PATENTS, INC. (US) 1991-07-16 US disclosed
EP-0349195-A2 Direct synthesis by cationic polymerization of nitrogen-containing polymers EXXON CHEMICAL PATENTS INC. (US) 1990-01-03 EP disclosed