SCHEMBL6159480

SCHEMBL6159480

C=CCn1ncc(N)c1C

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.34
HTT P42858 2/20 0.34
POLB P06746 2/20 0.34
MAPT P10636 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
MITF O75030 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
RECQL P46063 1/20 0.34
MCL1 Q07820 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
RAB9A P51151 1/20 0.33
TSHR P16473 1/20 0.32

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
SCHEMBL8664085 0.80 RAB9A (0.31) SMN1; SMN2RAB9ATSHR
SCHEMBL10987649 0.77 TSHR (0.50) SMN1; SMN2HTTPOLBMAPTTDP1
SCHEMBL14638402 0.75
SCHEMBL15651754 0.72 POLB (0.50) HTTPOLBMAPTALDH1A1RECQL
SCHEMBL31716780 0.72 HTR2A (0.36) SMN1; SMN2HTTPOLBMAPTTDP1
SCHEMBL22118930 0.72 TSHR (0.34) SMN1; SMN2HTTPOLBMITFALDH1A1
SCHEMBL6154188 0.71 CYP1A2 (0.33) TDP1TSHR
SCHEMBL16975489 0.71 CYP1A2 (0.39) SMN1; SMN2HTTPOLBMAPTALDH1A1
SCHEMBL6154539 0.71 HTR2A (0.34) SMN1; SMN2TSHR
SCHEMBL5021280 0.71 POLB (0.34) POLBTSHR

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-1580189-A1 4-AMINO-5-METHYLPYRAZOLE DERIVATIVES AND PROCESS FOR PRODUCTION THEREOF Sankyo Agro Company, Limited (JP) 2005-09-28 EP disclosed