SCHEMBL22048805

SCHEMBL22048805

C=CS(C)(C)c1ccc(Oc2ccc(S(C)(C)C=C)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 8/20 0.57
▸ SMN1; SMN2 Q16637 8/20 0.57
▸ LMNA P02545 7/20 0.57
▸ ALDH1A1 P00352 7/20 0.57
▸ NPC1 O15118 2/20 0.57
▸ RAB9A P51151 2/20 0.57
▸ TSHR P16473 2/20 0.57
▸ TP53 P04637 1/20 0.57
▸ MAPT P10636 1/20 0.57
▸ XBP1 P17861 1/20 0.57
▸ MAPK1 P28482 1/20 0.57
▸ MDM2 Q00987 1/20 0.57
▸ HSD17B10 Q99714 1/20 0.57
▸ POLB P06746 1/20 0.37
▸ SOS1 Q07889 2/20 0.36
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ GAA P10253 1/20 0.35
▸ PGR P06401 1/20 0.33
▸ CYP3A4 P08684 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
SCHEMBL19069989 0.85 TDP1 (0.37) HTTSMN1; SMN2LMNAALDH1A1NPC1
SCHEMBL21160747 0.73 TSHR (0.40) HTTSMN1; SMN2LMNAALDH1A1TSHR
SCHEMBL20999268 0.69 — —
SCHEMBL11547843 0.69 HTT (0.58) HTTSMN1; SMN2LMNAALDH1A1NPC1
SCHEMBL16683037 0.66 TDP1 (0.78) HTTSMN1; SMN2LMNAALDH1A1NPC1
SCHEMBL16590863 0.66 TDP1 (0.78) HTTSMN1; SMN2LMNAALDH1A1NPC1
SCHEMBL21795331 0.65 HTT (0.57) HTTSMN1; SMN2LMNAALDH1A1MAPT
SCHEMBL8941654 0.64 PTGS2 (0.56) HTTSMN1; SMN2LMNAALDH1A1
SCHEMBL21653914 0.64 SOS1 (0.55) HTTSMN1; SMN2LMNATSHRSOS1
SCHEMBL6090901 0.64 ALDH1A1 (0.58) HTTSMN1; SMN2LMNAALDH1A1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10793680-B2 Bridged silicone resin, film, electronic device and related methods DOW SILICONES CORPORATION (US) 2020-10-06 — — US disclosed
US-20200172679-A1 BRIDGED SILICONE RESIN, FILM, ELECTRONIC DEVICE AND RELATED METHODS DOW SILICONES CORPORATION 2020-06-04 — — US disclosed
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