SCHEMBL15569276

SCHEMBL15569276

CCOC(=O)c1nn(C)c(=O)c(-c2ccccc2)c1Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.49
SMN1; SMN2 Q16637 5/20 0.48
LMNA P02545 3/20 0.48
MAPT P10636 3/20 0.48
ALDH1A1 P00352 3/20 0.48
HPGD P15428 3/20 0.48
KDM4E B2RXH2 3/20 0.48
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
GAA P10253 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
TP53 P04637 4/20 0.47
CYP19A1 P11511 1/20 0.46
HSD17B10 Q99714 2/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
CYP3A4 P08684 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
POLB P06746 1/20 0.44

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
SCHEMBL18590180 0.90 MAPT (0.48) SMN1; SMN2LMNAMAPTALDH1A1HPGD
SCHEMBL15569851 0.87 TSHR (0.51) TSHRSMN1; SMN2LMNAMAPTALDH1A1
SCHEMBL15569022 0.86 TSHR (0.50) TSHRSMN1; SMN2LMNAMAPTALDH1A1
SCHEMBL17054065 0.85 PTGS2 (0.49) MAPTALDH1A1NPC1GAANPSR1
SCHEMBL15568546 0.84 TP53 (0.48) SMN1; SMN2LMNAALDH1A1HPGDTP53
SCHEMBL391742 0.78 KDM5B (0.45) SMN1; SMN2LMNAMAPTALDH1A1KDM4E
SCHEMBL18590178 0.76 SMN1; SMN2 (0.49) SMN1; SMN2LMNAMAPTALDH1A1HPGD
SCHEMBL18590177 0.76 KMT2A (0.40) SMN1; SMN2LMNAMAPTALDH1A1HPGD
SCHEMBL1753231 0.75 ALDH1A1 (0.57) TSHRSMN1; SMN2MAPTALDH1A1HPGD
SCHEMBL15569660 0.75 KDM5B (0.42) SMN1; SMN2LMNAMAPTALDH1A1HPGD

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-2014031971-A1 HERBICIDAL PYRIDAZINONES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2014-02-27 WO disclosed