SCHEMBL28201346

SCHEMBL28201346

CCC(=O)C1(O)CCC(C(F)(F)F)CC1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.31

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
SCHEMBL12461686 0.80 APP (0.32) MMP1
SCHEMBL6291490 0.77 MAPT (0.35)
SCHEMBL8380436 0.75
SCHEMBL4443122 0.75
SCHEMBL21242166 0.73 LMNA (0.41)
SCHEMBL9929369 0.72
SCHEMBL15125228 0.71
SCHEMBL13545128 0.71 TDP1 (0.32)
SCHEMBL13464582 0.70 MMP1 (0.38) MMP1
SCHEMBL1714458 0.69 ALDH1A1 (0.38)

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
CN-107698594-A Indoleamine 2,3 dioxygenase inhibitors and its purposes in pharmacy 苏州国匡医药科技有限公司 2018-02-16 CN disclosed