SCHEMBL9486124

SCHEMBL9486124

C[Si](C)(c1cccc(Cl)c1)c1cccc(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.42
ALDH1A1 P00352 1/20 0.42
NPC1 O15118 1/20 0.39
TP53 P04637 1/20 0.39
NFKB1 P19838 1/20 0.39
RAB9A P51151 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NOTUM Q6P988 2/20 0.38
PNMT P11086 2/20 0.38
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38
PTGS1 P23219 1/20 0.37
PTGS2 P35354 1/20 0.37
CHRM5 P08912 1/20 0.37
TAAR1 Q96RJ0 2/20 0.36
TDO2 P48775 1/20 0.36
IDO1 P14902 1/20 0.36

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
SCHEMBL3889788 0.85 TSHR (0.42) TSHRALDH1A1NPC1TP53NFKB1
SCHEMBL21196889 0.83 TSHR (0.41) TSHRALDH1A1NPC1TP53NFKB1
SCHEMBL22318993 0.83 TSHR (0.41) TSHRALDH1A1NPC1TP53NFKB1
SCHEMBL23532361 0.79 TSHR (0.46) TSHRALDH1A1NPC1TP53NFKB1
SCHEMBL28062826 0.78 ALDH1A1 (0.41) TSHRALDH1A1NPC1TP53NFKB1
SCHEMBL17937774 0.78 NOTUM (0.41) TSHRALDH1A1NPC1TP53NFKB1
SCHEMBL17966510 0.77 TSHR (0.44) TSHRALDH1A1NPC1TP53NFKB1
SCHEMBL17966523 0.77 TSHR (0.44) TSHRALDH1A1NPC1TP53NFKB1
SCHEMBL2335006 0.77 TSHR (0.44) TSHRALDH1A1NPC1TP53NFKB1
SCHEMBL31465211 0.77 TSHR (0.44) TSHRALDH1A1NPC1TP53NFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5256742-A Preparation of poly(arylene sulfide)s from poly(arylene sulfide disulfide) PHILLIPS PETROLEUM COMPANY (US) 1993-10-26 US disclosed
US-4370470-A Multistage, agitated contactor and its use in continuous production of arylene sulfide polymer PHILLIPS PETROLEUM COMPANY (US) 1983-01-25 US disclosed
EP-0044184-A2 Blend of polyarylene sulfide and wholly aromatic polyester CELANESE CORPORATION (US) 1982-01-20 EP disclosed
US-4276397-A IMPROVED PROCESSABILITY TO FORM MOLDED ARTICLES CELANESE CORPORATION (US) 1981-06-30 US disclosed