SCHEMBL11065352

SCHEMBL11065352

CCN(CC1CCCO1)C(=O)CCCCOc1cccc2c1NC(=O)CC2

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.41
MAPT P10636 2/20 0.39
ALDH1A1 P00352 2/20 0.39
GAA P10253 4/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
PDE3B Q13370 2/20 0.37
PDE3A Q14432 2/20 0.37
MEN1 O00255 3/20 0.36
HPGD P15428 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALOX15 P16050 1/20 0.36
HSD17B10 Q99714 1/20 0.36
OXTR P30559 2/20 0.36
AVPR1A P37288 2/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL11062853 0.79 PDE3B (0.61) KMT2AALDH1A1TSHRMAPK1PDE3B
SCHEMBL11067771 0.77 PDE3B (0.41) KMT2APDE3BPDE3AMEN1
SCHEMBL11068350 0.77 PDE3B (0.41) KMT2APDE3BPDE3AMEN1
SCHEMBL11071895 0.74 PDE3B (0.40) KMT2AMAPTGAAPDE3BPDE3A
SCHEMBL11062162 0.74 TRPM8 (0.44) KMT2ATSHRMAPK1PDE3BPDE3A
SCHEMBL11065412 0.73 PDE3B (0.59) KMT2AALDH1A1TSHRMAPK1PDE3B
SCHEMBL11058886 0.73 PDE3B (0.51) PDE3BPDE3A
SCHEMBL11069703 0.72 PDE3B (0.59) KMT2AALDH1A1TSHRMAPK1PDE3B
SCHEMBL11065776 0.72 ADRB2 (0.40) TSHRMAPK1PDE3BPDE3AHPGD
SCHEMBL11061370 0.71 PDE3B (0.35) PDE3BPDE3A

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-4435404-A ANTICOAGULANTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1984-03-06 US disclosed