SCHEMBL7964013

SCHEMBL7964013

Cc1cc(Cl)ccc1NC(=O)OCCSc1cccc(CSc2nc3ccccc3[nH]2)c1C

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AR P10275 5/20 0.46
SMN1; SMN2 Q16637 7/20 0.44
LMNA P02545 4/20 0.44
MAPK1 P28482 1/20 0.44
MPO P05164 1/20 0.44
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
RECQL P46063 1/20 0.42
POLB P06746 3/20 0.41
MAPT P10636 2/20 0.41
HTT P42858 1/20 0.41
PRMT5 O14744 1/20 0.40
WDR77 Q9BQA1 1/20 0.40
GAA P10253 1/20 0.40
PTPN1 P18031 1/20 0.40
CCNK O75909 1/20 0.40
CDK12 Q9NYV4 1/20 0.40

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
SCHEMBL7980183 0.92 AR (0.46) ARSMN1; SMN2LMNAMAPK1MPO
SCHEMBL7963992 0.90 AR (0.50) ARSMN1; SMN2LMNAMAPK1MPO
SCHEMBL7975321 0.88 AR (0.48) ARSMN1; SMN2LMNAMAPK1MPO
SCHEMBL7964041 0.87 POLB (0.47) ARSMN1; SMN2LMNAMAPK1MPO
SCHEMBL7963991 0.87 LMNA (0.45) ARSMN1; SMN2LMNAMAPK1MPO
SCHEMBL7974397 0.85 SMN1; SMN2 (0.50) ARSMN1; SMN2LMNAMAPK1MPO
SCHEMBL7977623 0.85 LMNA (0.55) ARSMN1; SMN2LMNAMAPK1MPO
SCHEMBL7977629 0.85 SMN1; SMN2 (0.48) ARSMN1; SMN2LMNAMPONPC1
SCHEMBL7964021 0.84 LMNA (0.47) ARSMN1; SMN2LMNAMAPK1MPO
SCHEMBL7974465 0.84 LMNA (0.47) ARSMN1; SMN2LMNAMAPK1MPO

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-2001034573-A1 COMPOUNDS ASTRAZENECA AB (SE) 2001-05-17 WO disclosed