SCHEMBL27352153

SCHEMBL27352153

C=C(C)Sc1cnccn1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.46
HSP90AA1 P07900 1/20 0.34
KDM4E B2RXH2 2/20 0.34
NAPRT Q6XQN6 1/20 0.34
HCAR2 Q8TDS4 1/20 0.34
BAZ2B Q9UIF8 1/20 0.33
ADORA3 P0DMS8 1/20 0.33
TSHR P16473 1/20 0.33
MC4R P32245 1/20 0.33
ADRA1A P35348 1/20 0.33
MC3R P41968 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
POLB P06746 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CTH P32929 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
SCHEMBL1479730 0.74 LMNA (0.55) LMNAHSP90AA1KDM4ENAPRTHCAR2
SCHEMBL8300321 0.74 LMNA (0.39) LMNAKDM4ESMN1; SMN2POLBALDH1A1
SCHEMBL7437060 0.72 ADORA3 (0.50) LMNAHSP90AA1KDM4ENAPRTHCAR2
SCHEMBL27943985 0.72 BAZ2B (0.50) LMNAHSP90AA1KDM4ENAPRTHCAR2
SCHEMBL1617422 0.72
SCHEMBL8083497 0.72
SCHEMBL15516303 0.71 LMNA (0.45) LMNAHSP90AA1KDM4ENAPRTHCAR2
SCHEMBL7211340 0.71 LMNA (0.45) LMNAHSP90AA1KDM4ENAPRTHCAR2
SCHEMBL22327277 0.68
SCHEMBL3504579 0.68

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1043887-C Chemically resistant compounds, their preparation and use KIM NAK DOO (KR) 1999-06-30 CN claimed
CN-1115981-A New chemopreventive compounds and a preparation method and use thereof WON KEUN CHUNG (KR) 1996-01-31 CN claimed
CN-1043887-C Chemically resistant compounds, their preparation and use KIM NAK DOO (KR) 1999-06-30 CN disclosed
CN-1115981-A New chemopreventive compounds and a preparation method and use thereof WON KEUN CHUNG (KR) 1996-01-31 CN disclosed