SCHEMBL25880494

SCHEMBL25880494

CCNC(=O)CCCCCN1CCCC1=O

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.52
KDM4E B2RXH2 1/20 0.52
ALDH1A1 P00352 1/20 0.52
TSHR P16473 1/20 0.52
HSD17B10 Q99714 1/20 0.52
KMT2A Q03164 4/20 0.50
RAB9A P51151 3/20 0.48
FAAH O00519 1/20 0.47
MAPK1 P28482 1/20 0.47
SMN1; SMN2 Q16637 4/20 0.46
NPC1 O15118 2/20 0.46
MEN1 O00255 2/20 0.46
HTT P42858 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL12424104 0.94 KMT2A (0.52) HPGDKDM4EALDH1A1TSHRHSD17B10
SCHEMBL12424124 0.88 KMT2A (0.55) TSHRKMT2ARAB9AMAPK1SMN1; SMN2
SCHEMBL21998656 0.85 MAPK1 (0.56) HPGDKDM4EALDH1A1TSHRHSD17B10
SCHEMBL21999368 0.85 MAPK1 (0.56) HPGDKDM4EALDH1A1TSHRHSD17B10
SCHEMBL21998655 0.85 MAPK1 (0.56) HPGDKDM4EALDH1A1TSHRHSD17B10
SCHEMBL5173365 0.83 KMT2A (0.58) HPGDKDM4EALDH1A1TSHRHSD17B10
Trimethylammonium SCHEMBL28144112 0.81 MAPK1 (0.52) HPGDKDM4EALDH1A1TSHRHSD17B10
SCHEMBL19513773 0.79 SMN1; SMN2 (0.49) HPGDKDM4EALDH1A1TSHRHSD17B10
SCHEMBL26005683 0.79 SMN1; SMN2 (0.68) HPGDKDM4EALDH1A1TSHRHSD17B10
SCHEMBL17057313 0.79 KMT2A (0.59) TSHRKMT2ARAB9AMAPK1SMN1; SMN2

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-4215179-A1 HYDROGEL COMPRISING DENDRITIC POLYGLYCEROL UNITS AND POLYETHER UNITS Freie Universität Berlin (DE) 2023-07-26 EP disclosed