SCHEMBL10540940

SCHEMBL10540940

CC(=O)N(CC(=O)N(CC(=O)O)c1ccc(Cl)cc1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.45
ALDH1A1 P00352 5/20 0.41
TSHR P16473 2/20 0.40
GLA P06280 2/20 0.40
LTB4R2 Q9NPC1 1/20 0.40
MMP2 P08253 1/20 0.40
MMP9 P14780 1/20 0.40
MLYCD O95822 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
HTT P42858 3/20 0.40
TP53 P04637 2/20 0.40
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
PAX8 Q06710 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
LMNA P02545 2/20 0.39
XBP1 P17861 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL10541018 0.95 NPSR1 (0.42) NPSR1MMP2MMP9LMNA
SCHEMBL10541378 0.91 ALDH1A1 (0.47) ALDH1A1TSHRGLALTB4R2MLYCD
SCHEMBL10540499 0.89 ALDH1A1 (0.46) ALDH1A1TSHRGLALTB4R2MLYCD
SCHEMBL10538089 0.89 NPSR1 (0.46) NPSR1ALDH1A1MMP2MMP9MLYCD
SCHEMBL10540452 0.87 MLYCD (0.46) NPSR1ALDH1A1TSHRLTB4R2MMP2
SCHEMBL10536974 0.87 ALDH1A1 (0.46) ALDH1A1TSHRGLAMLYCDMEN1
SCHEMBL690247 0.84 ALDH1A1 (0.53) ALDH1A1TSHRGLALTB4R2MEN1
Ammonia Solution, Strong SCHEMBL10539922 0.82 ALDH1A1 (0.52) ALDH1A1TSHRGLALTB4R2MEN1
SCHEMBL10536986 0.82 ALDH1A1 (0.52) ALDH1A1TSHRGLALTB4R2MEN1
SCHEMBL656829 0.79 CNR2 (0.52) ALDH1A1GLALTB4R2L3MBTL1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4846877-A CYCLIC DIMERS OF PHENYLGLYCINE TEIJIN LIMITED (JP) 1989-07-11 US disclosed
US-4772314-A PHENYLGLYCINES, MONOMERIC TEIJIN LIMITED (JP) 1988-09-20 US disclosed
EP-0194679-A2 Plant growth promoter and method of plant growth promotion TEIJIN LIMITED (JP) 1986-09-17 EP disclosed