SCHEMBL10306609

SCHEMBL10306609

CCC(=O)C(N)CCC(=O)Oc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.45
PRSS1 P07477 1/20 0.43
PRSS2 P07478 1/20 0.43
PRSS3 P35030 1/20 0.43
KMT2A Q03164 4/20 0.41
ALDH1A1 P00352 3/20 0.41
MAPT P10636 2/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
HSD17B10 Q99714 1/20 0.41
LTA4H P09960 1/20 0.41
ESR1 P03372 2/20 0.40
HIF1A Q16665 2/20 0.40
RECQL P46063 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
CYP19A1 P11511 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
EGFR P00533 1/20 0.37
ERBB2 P04626 1/20 0.37

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
SCHEMBL1810781 0.84 LTA4H (0.55) PRSS1PRSS2PRSS3KMT2AALDH1A1
SCHEMBL8064264 0.84 LTA4H (0.55) PRSS1PRSS2PRSS3KMT2AALDH1A1
SCHEMBL1810782 0.83 PRSS1 (0.47) ELANEPRSS1PRSS2PRSS3KMT2A
SCHEMBL27842369 0.82 LTA4H (0.52) PRSS1PRSS2PRSS3KMT2AALDH1A1
SCHEMBL19491916 0.81 LTA4H (0.46) PRSS1PRSS2PRSS3KMT2AALDH1A1
SCHEMBL28497163 0.80 PRSS1 (0.44) ELANEPRSS1PRSS2PRSS3KMT2A
SCHEMBL21319413 0.79 SLC15A1 (0.50) KMT2AALDH1A1LMNALTA4HMEN1
SCHEMBL4280827 0.78 SMN1; SMN2 (0.44) ALDH1A1MAPTLTA4HSMN1; SMN2
SCHEMBL666850 0.77 ALDH1A1 (0.48) ELANEPRSS1PRSS2PRSS3KMT2A
SCHEMBL31614987 0.77 ATM (0.40) ELANEPRSS1PRSS2PRSS3KMT2A

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
EP-2474306-A1 PARTICLE COMPOSITION AND MEDICINAL COMPOSITION COMPRISING SAME NanoCarrier Co., Ltd. (JP) 2012-07-11 EP disclosed