SCHEMBL17318327

SCHEMBL17318327

CC(C)(C)[Si](C)(C)OC1(c2ccccc2)CCC2(CC1)OCCO2

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 6/20 0.36
GAA P10253 4/20 0.36
POLB P06746 2/20 0.33
ALDH1A1 P00352 11/20 0.33
LMNA P02545 5/20 0.33
HTT P42858 1/20 0.32
KDM4E B2RXH2 5/20 0.32
HPGD P15428 4/20 0.32
HCRTR1 O43613 3/20 0.32
TDP1 Q9NUW8 3/20 0.32
CASP1 P29466 2/20 0.32
CASP7 P55210 2/20 0.32
HSD17B10 Q99714 2/20 0.32
ATM Q13315 1/20 0.32
KMT2A Q03164 1/20 0.32
TSHR P16473 1/20 0.32
MAPT P10636 2/20 0.31
OPRM1 P35372 2/20 0.31
MAPK1 P28482 1/20 0.31
GRIN2D O15399 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
SCHEMBL6132327 0.78 OPRM1 (0.47) L3MBTL1GAAPOLBALDH1A1TSHR
SCHEMBL17318349 0.78 MEN1 (0.46) GAAALDH1A1KMT2AOPRM1GRIN2D
SCHEMBL18283544 0.73 TAAR1 (0.35) ALDH1A1KDM4E
SCHEMBL24724099 0.72 MAPT (0.37) L3MBTL1GAAALDH1A1LMNAHTT
SCHEMBL3413530 0.71 ALDH1A1 (0.42) L3MBTL1GAAPOLBALDH1A1KDM4E
Lithium Ion SCHEMBL31036575 0.71 CA2 (0.37)
SCHEMBL747119 0.70 SLC6A4 (0.33)
SCHEMBL24724102 0.69
SCHEMBL24724096 0.69 ALDH1A1 (0.30) ALDH1A1
SCHEMBL18778704 0.69 POLB (0.41) L3MBTL1GAAPOLBALDH1A1CASP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10987322-B2 Immunoregulatory agents FLEXUS BIOSCIENCES, INC. (US) 2021-04-27 US disclosed
US-10987322-B2 Immunoregulatory agents FLEXUS BIOSCIENCES, INC. (US) 2021-04-27 US disclosed
US-20170112785-A1 IMMUNOREGULATORY AGENTS FLEXUS BIOSCIENCES, INC. 2017-04-27 US disclosed
EP-3151820-A1 IMMUNOREGULATORY AGENTS Flexus Biosciences, Inc. (US) 2017-04-12 EP disclosed
WO-2015188085-A1 IMMUNOREGULATORY AGENTS FLEXUS BIOSCIENCES, INC. (US) 2015-12-10 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170112785-A1 IMMUNOREGULATORY AGENTS IDO1, IDO2, INMT L3MBTL1 3766/4885GAA 1995/4885POLB 3533/4885
US-10987322-B2 Immunoregulatory agents IDO1, IDO2, INMT L3MBTL1 3766/4885GAA 1995/4885POLB 3533/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.