SCHEMBL19240080

SCHEMBL19240080

CCCN1CCC/C1=C\C=C1/C(=O)N(CC)C(=O)N1CC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 6/20 0.42
▸ KMT2A Q03164 6/20 0.42
▸ MAPT P10636 5/20 0.42
▸ ALDH1A1 P00352 5/20 0.42
▸ RAB9A P51151 3/20 0.42
▸ KDM4E B2RXH2 2/20 0.42
▸ IDE P14735 2/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ GAA P10253 3/20 0.38
▸ PSMD14 O00487 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ F2 P00734 1/20 0.32
▸ ELANE P08246 1/20 0.32
▸ CTSG P08311 1/20 0.32
▸ CTRC Q99895 1/20 0.32
▸ POLB P06746 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ RECQL P46063 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ USP2 O75604 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
SCHEMBL19240079 0.81 MEN1 (0.49) MEN1KMT2AMAPTALDH1A1RAB9A
SCHEMBL19240078 0.76 MEN1 (0.68) MEN1KMT2AMAPTALDH1A1RAB9A
SCHEMBL19240011 0.71 MEN1 (0.59) MEN1KMT2AMAPTALDH1A1RAB9A
SCHEMBL19240012 0.71 ALDH1A1 (0.36) MEN1KMT2AMAPTALDH1A1RAB9A
SCHEMBL19240009 0.69 ALDH1A1 (0.44) MEN1KMT2AMAPTALDH1A1RAB9A
SCHEMBL19240016 0.68 MAPT (0.50) MEN1KMT2AMAPTALDH1A1RAB9A
SCHEMBL10043 0.63 — —
SCHEMBL19058029 0.63 MEN1 (0.46) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL10416569 0.62 FKBP1A (0.41) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL8089341 0.62 FKBP1A (0.41) MEN1KMT2AMAPTALDH1A1KDM4E

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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