SCHEMBL15959120

SCHEMBL15959120

CCOC(=O)CCc1cc(OC)ccc1-c1ccc(-c2ccc(C)nc2)c(C(F)F)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 1/20 0.41
▸ PDE3A Q14432 1/20 0.41
▸ PTPN1 P18031 2/20 0.38
▸ CTSA P10619 1/20 0.37
▸ MTNR1A P48039 1/20 0.37
▸ MTNR1B P49286 1/20 0.37
▸ TSHR P16473 1/20 0.36
▸ DPP4 P27487 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ PPARG P37231 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ GAA P10253 2/20 0.35
▸ ABL1 P00519 1/20 0.35
▸ BCR P11274 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ CYP4F2 P78329 1/20 0.34
▸ CYP4A11 Q02928 1/20 0.34

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
SCHEMBL1812968 0.89 CYP11B2 (0.41) PTPN1MTNR1AMTNR1BTSHRPPARG
SCHEMBL1903298 0.86 MTNR1A (0.44) PTPN1MTNR1AMTNR1BTSHRPPARG
SCHEMBL35843129 0.86 MTNR1A (0.44) PTPN1MTNR1AMTNR1BTSHRPPARG
SCHEMBL1906562 0.83 MTNR1A (0.41) CTSAMTNR1AMTNR1BMEN1KMT2A
SCHEMBL1803863 0.77 CCNC (0.38) PTPN1MEN1KMT2ACYP4F2CYP4A11
SCHEMBL1804925 0.77 CYP11B2 (0.45) MTNR1AMTNR1BPPARGALDH1A1HPGD
SCHEMBL1815801 0.76 CYP11B2 (0.43) PTPN1MTNR1AMTNR1BTSHRPPARG
SCHEMBL1889329 0.76 CYP11B2 (0.49) PTPN1MTNR1AMTNR1BTSHRPPARG
SCHEMBL12660791 0.75 MTNR1A (0.43) PTPN1MTNR1AMTNR1BTSHRMEN1
SCHEMBL19209444 0.75 TLR8 (0.45) PTPN1MTNR1AMTNR1BTSHRPPARG

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
EP-2496544-B1 GPBP INHIBITION USING Q2 PEPTIDOMIMETICS FIBROSTATIN S L (SE) 2014-08-20 — — EP disclosed
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