SCHEMBL10770236

SCHEMBL10770236

O=Nc1ccc(Oc2ncccn2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.57
▸ KMT2A Q03164 2/20 0.57
▸ APAF1 O14727 1/20 0.57
▸ SMN1; SMN2 Q16637 5/20 0.56
▸ LMNA P02545 4/20 0.56
▸ ALDH1A1 P00352 3/20 0.56
▸ KDM4E B2RXH2 2/20 0.56
▸ RAB9A P51151 5/20 0.44
▸ MAPT P10636 5/20 0.43
▸ HTT P42858 2/20 0.43
▸ GAA P10253 1/20 0.43
▸ NPC1 O15118 3/20 0.42
▸ TSHR P16473 1/20 0.42
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.39
▸ HRH3 Q9Y5N1 1/20 0.37
▸ TLR4 O00206 1/20 0.36
▸ TLR2 O60603 1/20 0.36

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
SCHEMBL10139164 0.81 MEN1 (0.54) MEN1KMT2AAPAF1SMN1; SMN2LMNA
SCHEMBL10558423 0.79 SMN1; SMN2 (0.56) MEN1KMT2AAPAF1SMN1; SMN2LMNA
SCHEMBL8808020 0.78 ADRA2A (0.48) MEN1KMT2ASMN1; SMN2ALDH1A1RAB9A
SCHEMBL19484420 0.75 MMP1 (0.40) SMN1; SMN2LMNAALDH1A1HTTTSHR
SCHEMBL10620953 0.74 LTA4H (0.57) ALDH1A1HTTTSHRCYP3A4HSD17B10
SCHEMBL28840343 0.74 MEN1 (0.65) MEN1KMT2AAPAF1SMN1; SMN2LMNA
SCHEMBL667594 0.73 MEN1 (0.64) MEN1KMT2AAPAF1SMN1; SMN2LMNA
SCHEMBL6943230 0.72 MEN1 (0.63) MEN1KMT2AAPAF1SMN1; SMN2LMNA
SCHEMBL1748538 0.72 MEN1 (0.63) MEN1KMT2AAPAF1SMN1; SMN2LMNA
SCHEMBL22010907 0.72 MEN1 (0.63) MEN1KMT2AAPAF1SMN1; SMN2LMNA

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-0243868-A2 Pyridylthio-acylanilides BAYER AG (DE) 1987-11-04 — — EP disclosed
Send feedback