SCHEMBL8200922

SCHEMBL8200922

COC(=O)C(C)OP(=O)(O)C(Cc1ccccc1)NC(=O)OCc1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ECE1 P42892 10/20 0.57
MME P08473 9/20 0.57
ACE2 Q9BYF1 1/20 0.56
KYNU Q16719 1/20 0.53
F2 P00734 1/20 0.53
PLAU P00749 1/20 0.53
PLAT P00750 1/20 0.53
TRPM8 Q7Z2W7 1/20 0.51
ALDH1A1 P00352 1/20 0.51
ALOX15 P16050 1/20 0.51

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
SCHEMBL8197773 0.92 ECE1 (0.61) ECE1MMEACE2F2PLAU
SCHEMBL8197778 0.88 F2 (0.58) ECE1MMEACE2KYNUF2
SCHEMBL7397375 0.87 ECE1 (0.59) ECE1MMEACE2KYNUF2
SCHEMBL7291199 0.81 ECE1 (0.61) ECE1MMEACE2F2PLAU
SCHEMBL7328702 0.81 ECE1 (0.63) ECE1MMEACE2F2PLAU
SCHEMBL14334539 0.81 ECE1 (0.63) ECE1MMEACE2F2PLAU
SCHEMBL7397171 0.81 F2 (0.69) ECE1MMEACE2F2PLAU
SCHEMBL7397132 0.80 F2 (0.65) ECE1MMEACE2KYNUF2
SCHEMBL10482674 0.80 ECE1 (0.45) ECE1MMEACE2F2PLAU
SCHEMBL6928745 0.80 ECE1 (0.77) ECE1MMEACE2

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-0413762-B1 PEPTIDE ANALOGS AND THEIR USE AS HAPTENS TO ELICIT CATALYTIC ANTIBODIES IGEN INT INC (US) 2000-07-12 EP disclosed