SCHEMBL7294394

SCHEMBL7294394

CC(C)(C)SCC1(C(=O)NCC(=O)O)Cc2ccccc2C1

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MME P08473 2/20 0.63
PROC P04070 2/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.37
MMP8 P22894 1/20 0.36
HDAC9 Q9UKV0 1/20 0.35
HPGD P15428 1/20 0.35
RBP4 P02753 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
F2 P00734 1/20 0.34

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
SCHEMBL7294378 0.92 MME (0.56) MMEPROCNPC1RAB9AMEN1
SCHEMBL7300905 0.83 MME (0.64) MMEPROCMMP8HDAC9F2
SCHEMBL7301300 0.82 MME (0.40) MMENPC1RAB9ASMN1; SMN2MMP8
SCHEMBL7303622 0.80 MME (0.43) MMENPC1RAB9AMEN1KMT2A
SCHEMBL7292698 0.78 MME (0.38) MMENPC1RAB9ASMN1; SMN2HPGD
SCHEMBL7301621 0.77 MME (1.00) MMEMMP8HDAC9HPGD
SCHEMBL7295886 0.77 HTR2C (0.40) MMEMMP8
SCHEMBL7297983 0.76 MME (0.36) MMENPC1RAB9ASMN1; SMN2MEN1
SCHEMBL7303084 0.75 MME (0.57) MMEPROCMMP8
SCHEMBL7294410 0.73 GHSR (0.36) MMESMN1; SMN2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5252601-A 2-mercaptomethylene-tetrahydronaphthalene and indane-2-carboxamide derivatives as enkephalinase inhibitors MERRELL DOW PHARMACEUTICALS INC. (US) 1993-10-12 US disclosed
EP-0516980-A1 Novel 2-mercaptomethylene-tetrahydronaphthalene and indane-2-carboxamide derivatives as enkephalinase inhibitors MERRELL PHARMACEUTICALS INC. (US) 1992-12-09 EP disclosed