SCHEMBL27960232

SCHEMBL27960232

CCC1=C(OC)C(=O)N(C)C1=O

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PRMT1 Q99873 1/20 0.33
▸ RAB9A P51151 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.31
▸ MAPT P10636 1/20 0.31
▸ THRB P10828 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ APAF1 O14727 1/20 0.30

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
SCHEMBL11960695 0.78 MEN1 (0.33) ALDH1A1MAPT
SCHEMBL15470467 0.78 PRMT1 (0.39) PRMT1RAB9AALDH1A1MAPTTDP1
SCHEMBL10119694 0.70 ALDH1A1 (0.31) ALDH1A1
SCHEMBL13878855 0.70 CDC25A (0.37) PRMT1RAB9AALDH1A1MAPTTDP1
SCHEMBL30139973 0.69 MEN1 (0.30) —
SCHEMBL29562301 0.65 CASP3 (0.38) PRMT1RAB9AALDH1A1MAPTTDP1
SCHEMBL22246110 0.65 — —
SCHEMBL27892372 0.65 KDM4E (0.35) RAB9AMAPT
SCHEMBL10501153 0.64 MAPT (0.35) PRMT1ALDH1A1MAPTTHRBTDP1
SCHEMBL306363 0.64 ALDH1A1 (0.32) RAB9AALDH1A1MAPTTHRBTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103787947-A Maleimides ionic liquid and preparation method and application thereof OCEANS KING LIGHTING SCIENCE 2014-05-14 — — CN disclosed
Send feedback