SCHEMBL623626

SCHEMBL623626

CC(C)C(C)N(Oc1cc(Cc2ccccc2)cc(N)c1C#N)C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 6/20 0.36
MAPK9 P45984 5/20 0.36
RPS27 P42677 3/20 0.36
MAPK10 P53779 2/20 0.36
FNTA P49354 1/20 0.35
FNTB P49356 1/20 0.35
EGFR P00533 1/20 0.33
CTSL P07711 2/20 0.32
CTSB P07858 2/20 0.32
CTSS P25774 2/20 0.32
CTSK P43235 2/20 0.32
PRKD3 O94806 2/20 0.32
MEN1 O00255 1/20 0.32
TSHR P16473 1/20 0.32
KMT2A Q03164 1/20 0.32
CHUK O15111 1/20 0.32
MAP4K4 O95819 1/20 0.32
CDK2 P24941 1/20 0.32
CLK2 P49760 1/20 0.32
ITK Q08881 1/20 0.32

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
SCHEMBL617783 0.74 MAPK8 (0.40) MAPK8MAPK9RPS27MAPK10FNTA
SCHEMBL621914 0.73 MAPK8 (0.39) MAPK8MAPK9RPS27MAPK10FNTA
SCHEMBL15665534 0.63 KMT2A (0.39) MAPK8MAPK9RPS27MAPK10MEN1
SCHEMBL15665537 0.63 KMT2A (0.39) MAPK8MAPK9RPS27MAPK10MEN1
SCHEMBL15666129 0.63 KMT2A (0.39) MAPK8MAPK9RPS27MAPK10MEN1
SCHEMBL28457030 0.62 KMT2A (0.40) MAPK8MAPK9RPS27MAPK10FNTA
SCHEMBL31670289 0.60 CTSS (0.48) CTSLCTSBCTSSCTSK
SCHEMBL9493658 0.59 CALM1 (0.55) TSHRHSD17B10
SCHEMBL1681134 0.58 MAOB (0.44) FNTAFNTBMEN1TSHRKMT2A
Diphenylmethane SCHEMBL28095916 0.58 ALPI (0.55) ANPEP

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-2603098-A2 METHOD OF IMPROVING STABILITY OF SWEET ENHANCER AND COMPOSITION CONTAINING STABILIZED SWEET ENHANCER Senomyx, Inc. (US) 2013-06-19 EP disclosed
WO-2012021837-A2 METHOD OF IMPROVING STABILITY OF SWEET ENHANCER AND COMPOSITION CONTAINING STABILIZED SWEET ENHANCER SENOMYX, INC. (US) 2012-02-16 WO disclosed