SCHEMBL8000175

SCHEMBL8000175

CSCCC(NC(=O)CNC(=O)CN)C(=O)NC(CCCNC(=N)N)C(=O)NC(CCSC)C(=O)NCC(=O)NCC(=O)NCC(=O)O

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
QRFPR Q96P65 3/20 0.41
FNTA P49354 2/20 0.38
FNTB P49356 2/20 0.38
PGGT1B P53609 1/20 0.38
GRPR P30550 1/20 0.38
NPY4R P50391 6/20 0.37
NPY5R Q15761 6/20 0.37
NPY1R P25929 5/20 0.37
NPY2R P49146 3/20 0.37
IL23R Q5VWK5 2/20 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
SCHEMBL8000178 1.00 QRFPR (0.41) QRFPRFNTAFNTBPGGT1BGRPR
SCHEMBL8003506 0.90 FNTA (0.46) QRFPRFNTAFNTBPGGT1BNPY4R
SCHEMBL8003500 0.90 FNTA (0.46) QRFPRFNTAFNTBPGGT1BNPY4R
SCHEMBL30997463 0.90 QRFPR (0.41) QRFPRNPY4RNPY5RNPY1RNPY2R
SCHEMBL30373025 0.89 QRFPR (0.41) QRFPRNPY4RNPY5RNPY1RNPY2R
SCHEMBL30372279 0.89 QRFPR (0.41) QRFPRNPY4RNPY5RNPY1RNPY2R
SCHEMBL29590376 0.89 QRFPR (0.42) QRFPRNPY4RNPY5RNPY1RNPY2R
SCHEMBL29630426 0.89 QRFPR (0.42) QRFPRNPY4RNPY5RNPY1RNPY2R
SCHEMBL7987395 0.88 FNTA (0.46) FNTAFNTBPGGT1BNPY4RNPY5R
SCHEMBL7987388 0.88 FNTA (0.46) FNTAFNTBPGGT1BNPY4RNPY5R

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6291639-B1 ORGAN-SPECIFIC PROBES FOR TUMOR OR INFLAMMATION IMAGING; KITS WITH RADIISOTOPES INSTITUT FUE DIAGNOSTIKFORSCHUNG GMBH (DE) 2001-09-18 US claimed
US-6291639-B1 ORGAN-SPECIFIC PROBES FOR TUMOR OR INFLAMMATION IMAGING; KITS WITH RADIISOTOPES INSTITUT FUE DIAGNOSTIKFORSCHUNG GMBH (DE) 2001-09-18 US disclosed