SCHEMBL26257131

SCHEMBL26257131

CC(=O)N[C@H]1[C@H](OCCOCCN)O[C@H](C)[C@H](C)[C@@H]1C

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.37
▸ CXCL10 P02778 1/20 0.34
▸ CXCL8 P10145 1/20 0.34
▸ CCL2 P13500 1/20 0.34
▸ CCL5 P13501 1/20 0.34
▸ CXCL12 P48061 1/20 0.34
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ LGALS8 O00214 1/20 0.32
▸ LGALS3 P17931 1/20 0.32
▸ LGALS4 P56470 1/20 0.32
▸ CYP3A4 P08684 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ ASGR1 P07306 1/20 0.30

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
SCHEMBL27020203 0.86 MAPK1 (0.42) MAPK1CXCL10CXCL8CCL2CCL5
SCHEMBL25746360 0.83 CYP3A4 (0.43) MAPK1CXCL10CXCL8CCL2CCL5
SCHEMBL29330037 0.83 CYP3A4 (0.43) MAPK1CXCL10CXCL8CCL2CCL5
SCHEMBL12192303 0.79 MAPK1 (0.50) MAPK1CXCL10CXCL8CCL2CCL5
SCHEMBL26257060 0.77 CYP3A4 (0.42) MAPK1CXCL10CXCL8CCL2CCL5
SCHEMBL10261606 0.77 CYP3A4 (0.42) MAPK1CXCL10CXCL8CCL2CCL5
SCHEMBL19390477 0.77 CYP3A4 (0.42) MAPK1CXCL10CXCL8CCL2CCL5
SCHEMBL19390475 0.77 CYP3A4 (0.42) MAPK1CXCL10CXCL8CCL2CCL5
SCHEMBL14316901 0.77 CYP3A4 (0.51) KMT2ACYP3A4MAPTCYP2C9CYP2C19
SCHEMBL23133631 0.76 MAPK1 (0.65) MAPK1MEN1KMT2ALGALS8LGALS3

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-20230295630-A1 GALNAC COMPOSITIONS FOR IMPROVING SIRNA BIOAVAILABILITY EMPIRICO INC. 2023-09-21 — — US disclosed
Send feedback