SCHEMBL16731301

SCHEMBL16731301

CCCCC/C=C/C/C=C/CCCCCCCCOC(=O)C1C2CCC(O2)[C@@H]1C(=O)N1CCN(C)CC1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PPP5C P53041 2/20 0.47
▸ PPP2CA P67775 1/20 0.47
▸ TFPI2 P48307 1/20 0.47
▸ NPY4R P50391 1/20 0.47
▸ PPM1B O75688 1/20 0.42
▸ PTPN1 P18031 1/20 0.42
▸ PPP1CC P36873 1/20 0.42
▸ MGLL Q99685 1/20 0.38
▸ FAAH O00519 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ THRB P10828 1/20 0.38
▸ CNR1 P21554 1/20 0.38

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
SCHEMBL18047220 1.00 PPP5C (0.47) PPP5CPPP2CATFPI2NPY4RPPM1B
SCHEMBL16731419 1.00 PPP5C (0.47) PPP5CPPP2CATFPI2NPY4RPPM1B
SCHEMBL16731276 0.91 TFPI2 (0.56) PPP5CPPP2CATFPI2NPY4RPPM1B
SCHEMBL16731299 0.91 TFPI2 (0.56) PPP5CPPP2CATFPI2NPY4RPPM1B
SCHEMBL17585970 0.91 TFPI2 (0.56) PPP5CPPP2CATFPI2NPY4RPPM1B
SCHEMBL16731414 0.87 MGLL (0.37) MGLLFAAHALDH1A1MAPTTHRB
SCHEMBL16731300 0.82 TFPI2 (0.62) PPP5CPPP2CATFPI2NPY4RPPM1B
SCHEMBL16731415 0.79 PPARG (0.39) PPP5CPPP2CATFPI2NPY4RALDH1A1
SCHEMBL16731269 0.79 PPARG (0.39) PPP5CPPP2CATFPI2NPY4RALDH1A1
SCHEMBL18073234 0.77 TFPI2 (0.50) PPP5CPPP2CATFPI2NPY4RPPM1B

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
WO-2015073802-A1 PROTEIN PHOSPHATASE INHIBITORS THAT CROSS THE BLOOD BRAIN BARRIER LIXTE BIOTECHNOLOGY, INC. (US) 2015-05-21 — — WO disclosed
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