SCHEMBL5971672

SCHEMBL5971672

NC(=O)CCC(N)C(=O)NC(CC(=O)O)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.53
BLM P54132 1/20 0.53
PMP22 Q01453 1/20 0.53
KMT2A Q03164 1/20 0.53
DPP4 P27487 2/20 0.51
DPP8 Q6V1X1 2/20 0.51
DPP9 Q86TI2 2/20 0.51
BMP1 P13497 1/20 0.45
ENPEP Q07075 5/20 0.43
GNPAT O15228 1/20 0.42
ECE1 P42892 2/20 0.42
GRM8 O00222 1/20 0.41
GRM6 O15303 1/20 0.41
GRIN2D O15399 1/20 0.41
GRIN3B O60391 1/20 0.41
GSR P00390 1/20 0.41
CYP1A2 P05177 1/20 0.41
GRIK1 P39086 1/20 0.41
GRM5 P41594 1/20 0.41
GRIA1 P42261 1/20 0.41

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
SCHEMBL1674759 1.00 ALOX15 (0.53) ALOX15BLMPMP22KMT2ADPP4
SCHEMBL31514361 0.97 ALOX15 (0.50) ALOX15BLMPMP22KMT2ADPP4
Acetic Acid SCHEMBL30311271 0.95 DPP4 (0.51) ALOX15BLMPMP22KMT2ADPP4
SCHEMBL5971152 0.92 KMT2A (0.55) ALOX15BLMPMP22KMT2ADPP4
SCHEMBL20495523 0.92 KMT2A (0.55) ALOX15BLMPMP22KMT2ADPP4
SCHEMBL5971163 0.92 KMT2A (0.55) ALOX15BLMPMP22KMT2ADPP4
SCHEMBL1674757 0.90 DPP4 (0.54) DPP4DPP8DPP9BMP1ENPEP
SCHEMBL29517676 0.90 DPP4 (0.54) DPP4DPP8DPP9BMP1ENPEP
SCHEMBL1674753 0.90 DPP4 (0.54) DPP4DPP8DPP9BMP1ENPEP
SCHEMBL29630381 0.90 BMP1 (0.49) ALOX15BLMPMP22KMT2ADPP4

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-20060217321-A1 Compositions to improve tic disorders TAIYOKAGAKU CO., LTD. (JP) 2006-09-28 US disclosed