SCHEMBL3384980

SCHEMBL3384980

Cc1[nH]c2ccc(OC(F)(F)F)cc2c1CCNC(=O)c1ccc(C(=O)O)cc1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.61
KMT2A Q03164 3/20 0.61
MTNR1A P48039 2/20 0.55
MTNR1B P49286 2/20 0.55
TRPV1 Q8NER1 9/20 0.55
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
POLB P06746 2/20 0.51
SNCA P37840 1/20 0.51
CYP2C9 P11712 1/20 0.50
ATM Q13315 1/20 0.47
MAPT P10636 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
SCHEMBL3384642 0.92 MTNR1A (0.64) MEN1KMT2AMTNR1AMTNR1BTRPV1
SCHEMBL3382278 0.88 MEN1 (0.54) MEN1KMT2AMTNR1AMTNR1BTRPV1
SCHEMBL3382094 0.88 MTNR1A (0.72) MEN1KMT2AMTNR1AMTNR1BPOLB
SCHEMBL3382808 0.87 MEN1 (0.61) MEN1KMT2AMTNR1AMTNR1BTRPV1
SCHEMBL3385338 0.85 MEN1 (0.61) MEN1KMT2AMTNR1AMTNR1BTRPV1
SCHEMBL3262795 0.82 MEN1 (0.54) MEN1KMT2AMTNR1AMTNR1BTRPV1
SCHEMBL3227065 0.82 MTNR1A (0.77) MEN1KMT2AMTNR1AMTNR1BPOLB
SCHEMBL3261766 0.82 MEN1 (0.53) MEN1KMT2AMTNR1AMTNR1BTRPV1
SCHEMBL3382527 0.81 MEN1 (0.52) MEN1KMT2AMTNR1AMTNR1BTRPV1
SCHEMBL3382755 0.81 POLB (0.53) MEN1KMT2AMTNR1AMTNR1BNPC1

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
EP-2149552-A1 5,6 substituted benzamide derivatives as modulators of EP2 receptors Bayer Schering Pharma AG (DE) 2010-02-03 EP claimed
EP-2149552-A1 5,6 substituted benzamide derivatives as modulators of EP2 receptors Bayer Schering Pharma AG (DE) 2010-02-03 EP disclosed