SCHEMBL20798481

SCHEMBL20798481

CC(/C=C/I)C1CC(=O)N(C(C)C)C1=O

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.35
ALDH1A1 P00352 3/20 0.35
GAA P10253 3/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ALOX12 P18054 1/20 0.35
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
MME P08473 1/20 0.32

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
SCHEMBL19121034 0.78 MAPT (0.39) MAPTALDH1A1GAANPC1RAB9A
SCHEMBL4461827 0.77 MAPT (0.41) MAPTALDH1A1GAANPC1RAB9A
SCHEMBL20226663 0.76 MAPT (0.40) MAPTALDH1A1GAANPC1RAB9A
SCHEMBL23140222 0.74 MAPT (0.41) MAPTALDH1A1GAANPC1RAB9A
SCHEMBL21152760 0.74 MAPT (0.39) MAPTALDH1A1GAANPC1RAB9A
SCHEMBL21152368 0.71 ALDH1A1 (0.37) MAPTALDH1A1GAANPC1RAB9A
SCHEMBL23140677 0.70 MAPT (0.41) MAPTALDH1A1GAANPC1RAB9A
SCHEMBL19200889 0.70 MAPT (0.41) MAPTALDH1A1GAANPC1RAB9A
SCHEMBL14275617 0.70 MAPT (0.41) MAPTALDH1A1GAANPC1RAB9A
SCHEMBL24113818 0.69 ALDH1A1 (0.35) MAPTALDH1A1GAANPC1RAB9A

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
US-10227544-B2 Automotive transmission fluid compositions for improved energy efficiency INFINEUM INTERNATIONAL LIMITED (GB) 2019-03-12 US disclosed