SCHEMBL7247284

SCHEMBL7247284

C=C(C)c1cccc(C(C)(C)OC(N)=O)c1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.47
ALDH1A1 P00352 4/20 0.46
TSHR P16473 2/20 0.46
HTT P42858 2/20 0.46
MAPT P10636 2/20 0.46
LMNA P02545 1/20 0.46
GAA P10253 1/20 0.45
KDM4E B2RXH2 1/20 0.43

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
SCHEMBL1305465 0.85 L3MBTL1 (0.45) L3MBTL1ALDH1A1TSHRHTTMAPT
SCHEMBL9865144 0.85 L3MBTL1 (0.47) L3MBTL1ALDH1A1TSHRHTTMAPT
SCHEMBL29809260 0.84 KMT2A (0.44) ALDH1A1MAPTGAA
SCHEMBL9126205 0.82 ALDH1A1 (0.44) L3MBTL1ALDH1A1TSHRHTTMAPT
SCHEMBL8605985 0.82 L3MBTL1 (0.43) L3MBTL1ALDH1A1TSHRHTTMAPT
SCHEMBL7592368 0.81 L3MBTL1 (0.50) L3MBTL1ALDH1A1TSHRHTTMAPT
SCHEMBL9376685 0.81 L3MBTL1 (0.47) L3MBTL1ALDH1A1TSHRHTTMAPT
SCHEMBL1707006 0.80 L3MBTL1 (0.47) L3MBTL1ALDH1A1TSHRHTTMAPT
SCHEMBL8605989 0.80 SMN1; SMN2 (0.45) L3MBTL1ALDH1A1TSHRHTTMAPT
SCHEMBL9280074 0.79 MAPT (0.50) ALDH1A1TSHRHTTMAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190270054-A1 GAS SEPARATION MEMBRANES COMPRISING CROSSLINKED CELLULOSE ESTERS EASTMAN CHEMICAL COMPANY (US) 2019-09-05 US disclosed
EP-3490697-A1 GAS SEPARATION MEMBRANES COMPRISING CROSSLINKED CELLULOSE ESTERS Eastman Chemical Company (US) 2019-06-05 EP disclosed
US-6630599-B1 Blocked derivatives of m- or p- isopropenyl- alpha , alpha -dimethylbenzyl isocyanates, comprising reacting a meta- or a para-isopropenyl-alpha, alpha-dimethylbenzyl carbamate ester with hydroxy functional blocking group, such as CYTEC TECHNOLOGY CORP. 2003-10-07 US disclosed