SCHEMBL10873068

SCHEMBL10873068

CCN1CCN(C(=O)NC(C([NH])=O)c2ccc(OCc3ccccc3)cc2)C(=O)C1=O

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MMP2 P08253 1/20 0.42
▸ MMP9 P14780 1/20 0.42
▸ ADAM17 P78536 1/20 0.42
▸ ACACB O00763 1/20 0.41

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
SCHEMBL10873072 0.91 ALOX5 (0.44) —
SCHEMBL10872357 0.85 KMT2A (0.40) —
SCHEMBL10543056 0.85 ACACB (0.41) ACACB
SCHEMBL8113253 0.83 MAPT (0.43) —
SCHEMBL10643642 0.81 MAPT (0.36) —
SCHEMBL10493405 0.81 ATM (0.44) —
SCHEMBL10639866 0.78 FFAR1 (0.44) —
SCHEMBL10361855 0.78 FAAH (0.49) —
SCHEMBL10372875 0.78 GPR88 (0.39) —
SCHEMBL8597022 0.78 ATM (0.42) —

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-0191989-A1 Antibiotic isoxazole derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1986-08-27 — — EP disclosed
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