SCHEMBL9869191

SCHEMBL9869191

CN1CCN(C(=O)N[C@@H](C([NH])=O)c2ccc(O)cc2)C(=O)C1=O

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.34
▸ PDE3A Q14432 1/20 0.34
▸ SLC22A6 Q4U2R8 1/20 0.34
▸ SLC22A8 Q8TCC7 1/20 0.34
▸ SLC22A11 Q9NSA0 1/20 0.34
▸ THRB P10828 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ FOLH1 Q04609 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ CCKBR P32239 1/20 0.32
▸ LMNA P02545 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
SCHEMBL11197588 0.88 FOLH1 (0.43) MAPTPDE3ASLC22A6SLC22A8SLC22A11
SCHEMBL8113253 0.84 MAPT (0.43) MAPTPDE3ASLC22A6SLC22A8SLC22A11
SCHEMBL3731768 0.84 MAPT (0.43) MAPTPDE3ASLC22A6SLC22A8SLC22A11
SCHEMBL11212202 0.78 MEN1 (0.38) MEN1KMT2ACCKBRLMNA
SCHEMBL11605827 0.77 KMT2A (0.42) MEN1KMT2ACCKBRLMNA
SCHEMBL10755843 0.75 KMT2A (0.40) MEN1KMT2ACCKBRLMNA
SCHEMBL13485413 0.74 MEN1 (0.43) THRBMEN1KMT2ACCKBRLMNA
SCHEMBL9814590 0.72 MEN1 (0.38) MAPTPDE3ASLC22A6SLC22A8SLC22A11
SCHEMBL9567734 0.72 MAPT (0.46) MAPTPDE3ASLC22A6SLC22A8SLC22A11
SCHEMBL9327248 0.72 MAPT (0.46) MAPTPDE3ASLC22A6SLC22A8SLC22A11

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
WO-1991016327-A1 ANTIMICROBIAL QUINOLONYL LACTAMS NORWICH EATON PHARMACEUTICALS, INC. (US) 1991-10-31 — — WO disclosed
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