SCHEMBL15415552

SCHEMBL15415552

O=C1C(c2ccccn2)NCCN1c1ncccn1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 2/20 0.39
GFER P55789 3/20 0.39
ALDH1A1 P00352 5/20 0.38
MAPT P10636 3/20 0.38
DDB1 Q16531 1/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
KMT2A Q03164 1/20 0.38
ALOX5 P09917 1/20 0.36
GSK3B P49841 1/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
KDM4E B2RXH2 2/20 0.35
ATM Q13315 1/20 0.35
CYP1A2 P05177 1/20 0.34
CYP2C19 P33261 1/20 0.34
SHMT2 P34897 1/20 0.34
HPGD P15428 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL15415551 0.73 CRBN (0.49) CRBNALDH1A1MAPTKMT2AALOX5
SCHEMBL12324357 0.69 PLD1 (0.41) GFERALDH1A1MAPTNPC1RAB9A
SCHEMBL2419530 0.69 ALDH1A1 (0.60) CRBNGFERALDH1A1MAPTDDB1
SCHEMBL29223441 0.68 CRBN (0.43) CRBNALDH1A1MAPTKMT2AALOX5
SCHEMBL7839621 0.68 ROCK2 (0.37) CRBNALDH1A1MAPTDDB1NPC1
SCHEMBL30702779 0.66 CRBN (0.63) CRBNALDH1A1KMT2AALOX5GSK3B
SCHEMBL2198674 0.66 CRBN (0.63) CRBNALDH1A1KMT2AALOX5GSK3B
SCHEMBL17596684 0.66 ALDH1A1 (0.40) GFERALDH1A1MAPTNPC1SMN1; SMN2
SCHEMBL29794136 0.66 ALDH1A1 (0.40) GFERALDH1A1MAPTNPC1SMN1; SMN2
SCHEMBL9372641 0.64 ALDH1A1 (0.42) CRBNALDH1A1MAPTDDB1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2872508-A1 IMIDAZOPYRIDINE DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB Biopharma SPRL (BE) 2015-05-20 EP disclosed
WO-2014009295-A1 IMIDAZOPYRIDINE DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB PHARMA S.A. (BE) 2014-01-16 WO disclosed