SCHEMBL7376256

SCHEMBL7376256

CCOP(=O)(CCc1ccccc1)CC(=O)O

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CETP P11597 4/20 0.44
TSHR P16473 1/20 0.44
MMP9 P14780 2/20 0.42
MMP1 P03956 1/20 0.42
MMP3 P08254 1/20 0.42
ADAM17 P78536 1/20 0.42
ADAM9 Q13443 1/20 0.42
KEAP1 Q14145 1/20 0.42
POLB P06746 2/20 0.41
LMNA P02545 1/20 0.41
LTA4H P09960 1/20 0.40
EPHX2 P34913 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
NPC1 O15118 1/20 0.40
MAPT P10636 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL11513875 0.91 HDAC3 (0.45) CETPTSHRKEAP1LMNAMAPT
SCHEMBL7379497 0.90 CETP (0.47) CETPTSHRMAPTSMN1; SMN2
SCHEMBL7381330 0.86 TSHR (0.51) CETPTSHRKEAP1SMN1; SMN2
SCHEMBL28373033 0.83 CETP (0.45) CETPTSHRMMP9MMP1MMP3
SCHEMBL10936389 0.79 ALDH1A1 (0.46) CETPTSHRMMP9MMP1MMP3
SCHEMBL11512016 0.77 CETP (0.49) CETPTSHRKEAP1LMNAMAPT
SCHEMBL10890173 0.77 MAPT (0.51) CETPTSHRKEAP1LMNAMAPT
SCHEMBL10784401 0.77 CYP1A2 (0.51)
SCHEMBL10936405 0.76 SMN1; SMN2 (0.48) TSHRMMP9MMP1MMP3ADAM17
SCHEMBL7342161 0.76 ALDH1A1 (0.39) CETP

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0053902-B1 PHOSPHINYLALKANOYL SUBSTITUTED PROLINES E.R. Squibb & Sons, Inc. (US) 1985-04-03 EP disclosed
US-4384123-A Phosphinylalkanoyl substituted prolines E. R. SQUIBB & SONS, INC. (US) 1983-05-17 US disclosed
US-4337201-A Phosphinylalkanoyl substituted prolines E. R. SQUIBB & SONS, INC. (US) 1982-06-29 US disclosed
EP-0053902-A1 Phosphinylalkanoyl substituted prolines E.R. Squibb & Sons, Inc. (US) 1982-06-16 EP disclosed
US-4168267-A Phosphinylalkanoyl prolines E. R. SQUIBB & SONS, INC. (US) 1979-09-18 US disclosed