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SCHEMBL10535214

SCHEMBL10535214

CC(NC(=O)C(Cc1ccc(O)cc1)NC(=O)C(CCC(=O)O)NC(=O)C(CCCCN)NC(=O)C(CCC(N)=O)NC(=O)C(NC(=O)C(CCCCN)NC(=O)CNC(=O)C(N)CCCNC(=N)N)C(C)C)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TFPI P10646 1/20 0.62
▸ NPY4R P50391 8/20 0.54
▸ NPY1R P25929 5/20 0.54
▸ NPY2R P49146 4/20 0.54
▸ NPY5R Q15761 4/20 0.54
▸ KEAP1 Q14145 1/20 0.53
▸ IL23R Q5VWK5 5/20 0.52

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
SCHEMBL10535233 1.00 TFPI (0.62) TFPINPY4RNPY1RNPY2RNPY5R
SCHEMBL30567797 0.93 TFPI (0.62) TFPINPY4RNPY1RNPY2RNPY5R
SCHEMBL29777861 0.91 TFPI (0.62) TFPINPY4RNPY1RNPY2RNPY5R
SCHEMBL29974215 0.90 TFPI (0.68) TFPIKEAP1IL23R
SCHEMBL29512407 0.90 NPY4R (0.58) TFPINPY4RNPY1RNPY2RNPY5R
SCHEMBL31757517 0.90 NPY4R (0.54) TFPINPY4RNPY1RNPY2RNPY5R
SCHEMBL30558178 0.88 NPY4R (0.59) TFPINPY4RNPY1RNPY2RNPY5R
SCHEMBL29430569 0.88 TFPI (0.70) TFPINPY4RNPY1RNPY2RNPY5R
SCHEMBL8815384 0.88 NPY4R (0.62) TFPINPY4RNPY1RNPY2RNPY5R
SCHEMBL8813021 0.88 NPY4R (0.62) TFPINPY4RNPY1RNPY2RNPY5R

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-1989010416-A1 PROTECTIVE PEPTIDES DERIVED FROM HUMAN IMMUNODEFICIENCY VIRUS-1 gp160 TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 1989-11-02 — — WO claimed
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