SCHEMBL28200093

SCHEMBL28200093

NNP(=O)(O)Oc1ccc(Cl)c(Cl)c1Cl

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
INPPL1 O15357 3/20 0.33
INPP5A Q14642 2/20 0.33
ALPL P05186 1/20 0.33
AKT1 P31749 1/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
FABP3 P05413 1/20 0.33
MRGPRX4 Q96LA9 1/20 0.33
CYP3A4 P08684 1/20 0.32
MAPK1 P28482 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MMP8 P22894 1/20 0.30
MMP14 P50281 1/20 0.30
CA14 Q9ULX7 1/20 0.30
SFN P31947 1/20 0.30

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
SCHEMBL28200081 0.81 ALDH1A1 (0.33) INPPL1INPP5AALPLAKT1LMNA
SCHEMBL258268 0.80 INPPL1 (0.54) INPPL1INPP5AAKT1LMNASMN1; SMN2
SCHEMBL30023648 0.80 INPPL1 (0.54) INPPL1INPP5AAKT1LMNASMN1; SMN2
SCHEMBL28046072 0.77 LMNA (0.59) INPPL1INPP5ALMNASMN1; SMN2MAPK1
SCHEMBL258267 0.75 LMNA (0.36) INPPL1INPP5AAKT1LMNASMN1; SMN2
SCHEMBL28856235 0.75 LMNA (0.39) INPPL1INPP5ALMNASMN1; SMN2MAPK1
SCHEMBL28856233 0.75 ALDH1A1 (0.38) INPPL1INPP5AALDH1A1CA14
SCHEMBL25269222 0.74 LMNA (0.33) LMNASMN1; SMN2FABP3MRGPRX4CYP3A4
SCHEMBL31661065 0.74 LMNA (0.35) INPPL1INPP5AAKT1LMNASMN1; SMN2
SCHEMBL11126358 0.72 CYP3A4 (0.38) INPPL1INPP5AAKT1FABP3MRGPRX4

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
CN-107663161-A A kind of continuous stream synthesis technique of phenylhydrazine salt and substituted benzene hydrazonium salt 上海惠和化德生物科技有限公司 2018-02-06 CN disclosed