SCHEMBL19240004

SCHEMBL19240004

CN1CCS/C1=C\C=C1C(=O)OC(C)(C)OC1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 13/20 0.48
▸ MEN1 O00255 8/20 0.48
▸ KMT2A Q03164 8/20 0.48
▸ MAPT P10636 8/20 0.48
▸ RAB9A P51151 7/20 0.48
▸ NPC1 O15118 6/20 0.48
▸ SMN1; SMN2 Q16637 5/20 0.48
▸ TNNI3 P19429 3/20 0.48
▸ TNNT2 P45379 3/20 0.48
▸ TNNC1 P63316 3/20 0.48
▸ MAPK1 P28482 3/20 0.47
▸ LMNA P02545 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ STAT1 P42224 1/20 0.46
▸ CYP1A2 P05177 2/20 0.42
▸ CYP2C19 P33261 2/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ L3MBTL1 Q9Y468 3/20 0.39
▸ USP2 O75604 3/20 0.39
▸ POLB P06746 2/20 0.39

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
SCHEMBL19239997 0.81 MEN1 (0.33) ALDH1A1MEN1KMT2AMAPTRAB9A
SCHEMBL19240020 0.77 ALDH1A1 (0.47) ALDH1A1MEN1KMT2AMAPTRAB9A
SCHEMBL14279368 0.73 KMT2A (0.56) ALDH1A1MEN1KMT2AMAPTRAB9A
SCHEMBL2058445 0.73 KMT2A (0.56) ALDH1A1MEN1KMT2AMAPTRAB9A
SCHEMBL2058443 0.73 KMT2A (0.56) ALDH1A1MEN1KMT2AMAPTRAB9A
SCHEMBL19038901 0.71 ALDH1A1 (0.47) ALDH1A1MEN1KMT2AMAPTRAB9A
SCHEMBL19038912 0.71 ALDH1A1 (0.47) ALDH1A1MEN1KMT2AMAPTRAB9A
SCHEMBL13683561 0.66 MEN1 (0.45) ALDH1A1MEN1KMT2AMAPTRAB9A
SCHEMBL13683582 0.66 MEN1 (0.45) ALDH1A1MEN1KMT2AMAPTRAB9A
SCHEMBL13683583 0.66 MEN1 (0.47) ALDH1A1MEN1KMT2AMAPTRAB9A

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-20170235032-A1 OPTICAL FILM SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-08-17 — — US disclosed
US-20170235032-A1 OPTICAL FILM SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-08-17 — — US disclosed
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