SCHEMBL8367195

SCHEMBL8367195

COC(=O)C(=O)/C=C(\O)c1ccc(C)c(C)c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.69
ALDH1A1 P00352 2/20 0.69
KDM4E B2RXH2 1/20 0.69
CES2 O00748 1/20 0.45
CES1 P23141 1/20 0.45
TAS1R3 Q7RTX0 2/20 0.42
TAS1R1 Q7RTX1 2/20 0.42
GAA P10253 3/20 0.41
LMNA P02545 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 6/20 0.41
MEN1 O00255 4/20 0.41
NR1H4 Q96RI1 1/20 0.40
RAB9A P51151 3/20 0.40
NPC1 O15118 2/20 0.40
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 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
SCHEMBL8367198 1.00 MAPT (0.69) MAPTALDH1A1KDM4ECES2CES1
SCHEMBL27101307 0.88 KDM4E (0.65) MAPTALDH1A1KDM4EGAALMNA
SCHEMBL8369833 0.86 ALDH1A1 (0.63) MAPTALDH1A1KDM4ETAS1R3TAS1R1
SCHEMBL8369834 0.86 ALDH1A1 (0.63) MAPTALDH1A1KDM4ETAS1R3TAS1R1
SCHEMBL8040827 0.83 CA12 (0.55) MAPTALDH1A1KDM4ECES2CES1
SCHEMBL8040833 0.83 CA12 (0.55) MAPTALDH1A1KDM4ECES2CES1
SCHEMBL8368078 0.81 ALDH1A1 (1.00) MAPTALDH1A1KDM4ECES2CES1
SCHEMBL8368077 0.81 ALDH1A1 (1.00) MAPTALDH1A1KDM4ECES2CES1
SCHEMBL3681348 0.79 KDM4E (0.62) MAPTALDH1A1KDM4ESMN1; SMN2KMT2A
SCHEMBL8367177 0.79 KDM4E (0.62) MAPTALDH1A1KDM4ESMN1; SMN2KMT2A

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-5925768-A ANTIINFLAMMATORY AGENTS; ANALGESICS, ANTICOAGULANTS, NARCOTICS SANOFI (FR) 1999-07-20 US disclosed