SCHEMBL16864409

SCHEMBL16864409

C=C1c2ccccc2C(c2ccc(Cl)c(Cl)c2)N1c1ccc2[nH]cnc2c1

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ QPCT Q16769 18/20 0.46
▸ TP53 P04637 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL16864397 0.90 QPCT (0.48) QPCTTP53
SCHEMBL29410480 0.88 QPCT (0.60) QPCT
SCHEMBL1444481 0.88 QPCT (0.60) QPCT
SCHEMBL16864406 0.83 QPCT (0.43) QPCT
SCHEMBL12819253 0.83 QPCT (0.68) QPCTTP53MAPTSMN1; SMN2
SCHEMBL12819597 0.83 QPCT (0.68) QPCTTP53MAPTSMN1; SMN2
SCHEMBL12814445 0.81 QPCT (0.57) QPCTTP53SMN1; SMN2
SCHEMBL1444692 0.77 QPCT (0.60) QPCTTP53SMN1; SMN2
SCHEMBL1444480 0.77 QPCT (0.60) QPCTTP53SMN1; SMN2
SCHEMBL29410482 0.77 QPCT (0.60) QPCTTP53SMN1; SMN2

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-2475428-B1 HETEROCYLCIC DERIVATIVES AS INHIBITORS OF GLUTAMINYL CYCLASE PROBIODRUG AG (DE) 2015-07-01 — — EP disclosed
Send feedback