SCHEMBL8441231

SCHEMBL8441231

CCN(CC)c1ccc(C=C(C)C=O)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 13/20 0.63
▸ ALDH3A1 P30838 1/20 0.63
▸ ALDH1A3 P47895 1/20 0.63
▸ GAA P10253 4/20 0.56
▸ KDM4E B2RXH2 3/20 0.56
▸ TSHR P16473 3/20 0.53
▸ MAPT P10636 10/20 0.51
▸ MEN1 O00255 10/20 0.51
▸ KMT2A Q03164 10/20 0.51
▸ POLB P06746 4/20 0.51
▸ MAPK1 P28482 8/20 0.48
▸ L3MBTL1 Q9Y468 6/20 0.48
▸ TDP1 Q9NUW8 5/20 0.48
▸ NPSR1 Q6W5P4 3/20 0.48
▸ RECQL P46063 3/20 0.47
▸ USP2 O75604 2/20 0.47
▸ TLR9 Q9NR96 1/20 0.47
▸ LMNA P02545 6/20 0.46
▸ GFER P55789 2/20 0.45
▸ GLA P06280 1/20 0.45

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
SCHEMBL8441229 1.00 ALDH1A1 (0.63) ALDH1A1ALDH3A1ALDH1A3GAAKDM4E
SCHEMBL19287553 0.81 ALDH1A1 (0.61) ALDH1A1ALDH3A1ALDH1A3GAAKDM4E
SCHEMBL8437202 0.79 HDAC3 (0.60) ALDH1A1GAATSHRMAPTMEN1
SCHEMBL8437200 0.79 HDAC3 (0.60) ALDH1A1GAATSHRMAPTMEN1
SCHEMBL15145056 0.79 ALDH1A1 (0.59) ALDH1A1ALDH3A1ALDH1A3GAAKDM4E
SCHEMBL10981269 0.79 ALDH1A1 (0.58) ALDH1A1ALDH3A1ALDH1A3GAAKDM4E
SCHEMBL10981268 0.79 ALDH1A1 (0.58) ALDH1A1ALDH3A1ALDH1A3GAAKDM4E
SCHEMBL195135 0.78 ALDH1A1 (1.00) ALDH1A1ALDH3A1ALDH1A3GAAKDM4E
SCHEMBL5733313 0.78 ALDH1A1 (1.00) ALDH1A1ALDH3A1ALDH1A3GAAKDM4E
SCHEMBL19141845 0.78 ALDH1A1 (0.58) ALDH1A1ALDH3A1ALDH1A3GAAKDM4E

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
EP-0419095-B1 Radiation sensitive compositions AGFA GEVAERT NV (BE) 1999-12-29 — — EP disclosed
US-5264329-A Radiation sensitive compositions DUPONT (U.K.) LIMITED (GB) 1993-11-23 — — US disclosed
US-5130228-A Photosensitive material, a dye which will change color on radiation, a multilayer device DUPONT-HOWSON LIMITED (GB) 1992-07-14 — — US disclosed
EP-0419095-A2 Radiation sensitive compositions Du Pont (UK) Limited (GB) 1991-03-27 — — EP disclosed
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