SCHEMBL12819161

SCHEMBL12819161

C=C1c2c(Cl)ccc(Cl)c2C(c2ccc(OC)cc2)N1c1ccc2[nH]cnc2c1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ QPCT Q16769 17/20 0.40
▸ QPCTL Q9NXS2 2/20 0.39
▸ MMP12 P39900 1/20 0.37
▸ ABL1 P00519 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ RIN1 Q13671 1/20 0.33
▸ MDM4 O15151 1/20 0.33
▸ MDM2 Q00987 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
SCHEMBL1444741 0.89 QPCT (0.44) QPCTQPCTLABL1KMT2ARIN1
SCHEMBL1444755 0.75 QPCT (0.51) QPCTQPCTLMDM4MDM2
SCHEMBL1444367 0.71 QPCT (0.68) QPCTQPCTLKMT2A
SCHEMBL1445244 0.69 QPCT (0.66) QPCTQPCTL
SCHEMBL12732479 0.69 QPCT (0.45) QPCTQPCTLMMP12ABL1KMT2A
SCHEMBL16864409 0.69 QPCT (0.46) QPCT
SCHEMBL16864397 0.69 QPCT (0.48) QPCTQPCTLMDM2
SCHEMBL1444694 0.69 QPCT (0.47) QPCTQPCTLMMP12
SCHEMBL1444517 0.67 QPCT (0.46) QPCTQPCTLMMP12ABL1KMT2A
SCHEMBL12819253 0.67 QPCT (0.68) QPCTKMT2A

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-2011029920-A1 HETEROCYLCIC DERIVATIVES AS INHIBITORS OF GLUTAMINYL CYCLASE PROBIODRUG AG (DE) 2011-03-17 — — WO disclosed
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