SCHEMBL18698224

SCHEMBL18698224

CCOC(=O)C1(C)C(=O)C(=O)N(c2ccc3[nH]cnc3c2)C1c1cccc(F)c1F

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ QPCT Q16769 16/20 0.43
▸ POLB P06746 1/20 0.35
▸ GAA P10253 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ HSD11B1 P28845 1/20 0.34
▸ TP53 P04637 1/20 0.33

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
SCHEMBL14134297 0.86 POLB (0.34) QPCTPOLBGAAKMT2AHSD11B1
SCHEMBL14148472 0.83 QPCT (0.51) QPCTHSD11B1
SCHEMBL12273935 0.77 QPCT (0.49) QPCT
SCHEMBL2381919 0.77 QPCT (0.52) QPCT
SCHEMBL4300306 0.74 ALDH1A1 (0.53) QPCTPOLBGAAKMT2A
SCHEMBL4305666 0.73 QPCT (0.55) QPCT
Hydrochloric Acid SCHEMBL2382192 0.73 QPCT (0.54) QPCT
SCHEMBL14148277 0.73 QPCT (0.54) QPCT
SCHEMBL14148282 0.73 QPCT (0.54) QPCT
SCHEMBL2381935 0.71 QPCT (0.50) QPCT

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
US-9610368-B2 Radiolabelled glutaminyl cyclase (QC) inhibitors and uses of same PROBIODRUG AG (DE) 2017-04-04 — — US disclosed
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