SCHEMBL25538504

SCHEMBL25538504

CC(C)(CC(Br)C(=O)O)C(=O)OCC(COCC(COC(=O)C(C)(C)CC(Br)C(=O)O)(COC(=O)C(C)(C)CC(Br)C(=O)O)COC(=O)C(C)(C)CC(Br)C(=O)O)(COC(=O)C(C)(C)CC(Br)C(=O)O)COC(=O)C(C)(C)CC(Br)C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.32
HIF1A Q16665 1/20 0.32
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.31

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
SCHEMBL20100216 0.95 ALDH1A1 (0.34) MAPK1HIF1AALDH1A1TSHR
SCHEMBL13857020 0.89 MAPK1 (0.31) MAPK1HIF1AALDH1A1TSHR
SCHEMBL20100213 0.79
SCHEMBL25538572 0.79 CHRM1 (0.35)
SCHEMBL20100217 0.75
SCHEMBL21734082 0.73 MMP8 (0.44) MAPK1HIF1A
SCHEMBL17358191 0.73
SCHEMBL25538542 0.73 CHRM1 (0.38)
SCHEMBL1170979 0.71 MAPK1 (0.31) MAPK1HIF1A
SCHEMBL4540183 0.71 MAPK1 (0.35) MAPK1HIF1A

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-11654402-B2 Polyacid-functionalized porous membranes, related methods, and related polyacid polymers BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2023-05-23 US disclosed