SCHEMBL6791691

SCHEMBL6791691

CCCCC(NC(=O)CNC(=O)Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCKAR P32238 1/20 0.51
CCKBR P32239 1/20 0.51
OPRD1 P41143 1/20 0.51
MTNR1A P48039 2/20 0.50
ERAP2 Q6P179 2/20 0.49
ERAP1 Q9NZ08 2/20 0.49
LNPEP Q9UIQ6 2/20 0.49
KMT2A Q03164 1/20 0.49
ALOX15 P16050 1/20 0.49
LMNA P02545 2/20 0.49
MMP2 P08253 1/20 0.48
MMP9 P14780 1/20 0.48
MMP8 P22894 1/20 0.48
ACE P12821 2/20 0.48
MAPT P10636 1/20 0.48
PKM P14618 1/20 0.48
P2RY14 Q15391 1/20 0.48
TP53 P04637 1/20 0.48
POLB P06746 1/20 0.48
GAA P10253 1/20 0.47

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
SCHEMBL4745190 0.92 P2RY14 (0.54) MTNR1AERAP2ERAP1LNPEPKMT2A
SCHEMBL1129962 0.89 P2RY14 (0.53) MTNR1AERAP2ERAP1LNPEPKMT2A
SCHEMBL17244051 0.82 MTNR1A (0.62) MTNR1AKMT2AALOX15ACEMAPT
SCHEMBL29429300 0.82 MTNR1A (0.62) MTNR1AKMT2AALOX15ACEMAPT
SCHEMBL29429324 0.82 MTNR1A (0.62) MTNR1AKMT2AALOX15ACEMAPT
SCHEMBL29674779 0.82 MTNR1A (0.62) MTNR1AKMT2AALOX15ACEMAPT
SCHEMBL29640391 0.82 MTNR1A (0.62) MTNR1AKMT2AALOX15ACEMAPT
SCHEMBL29429295 0.81 MTNR1A (0.61) MTNR1AKMT2AALOX15ACEMAPT
SCHEMBL29674872 0.81 MTNR1A (0.61) MTNR1AKMT2AALOX15ACEMAPT
SCHEMBL3344871 0.81 MC4R (0.55) ERAP2ALOX15LMNAACEP2RY14

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-6825354-B2 OSTEOPOROSIS; RHEUMATIC DISEASES WYETH HOLDINGS CORPORATION 2004-11-30 US disclosed