SCHEMBL7829950

SCHEMBL7829950

COc1ccc2[nH]c(=O)c3nn[nH]c3c(=O)c2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 3/20 0.53
ABCG2 Q9UNQ0 1/20 0.51
STING1 Q86WV6 1/20 0.49
ALDH1A1 P00352 9/20 0.47
KDM4E B2RXH2 8/20 0.47
HSD17B10 Q99714 4/20 0.47
MAPT P10636 3/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
TSHR P16473 1/20 0.47
GFER P55789 1/20 0.47
GSK3A P49840 2/20 0.47
GSK3B P49841 2/20 0.47
CTSV O60911 1/20 0.46
CTSL P07711 1/20 0.46
HPGD P15428 6/20 0.46
PDGFRB P09619 1/20 0.45
GAA P10253 3/20 0.44
TP53 P04637 1/20 0.44
HTT P42858 1/20 0.44

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
SCHEMBL7826292 0.90 KDM4E (0.47) DYRK1AABCG2STING1ALDH1A1KDM4E
SCHEMBL7823545 0.86 KMT2A (0.52) ALDH1A1KDM4EHSD17B10MAPTMEN1
SCHEMBL9216251 0.86 PARP1 (0.49) DYRK1AABCG2STING1ALDH1A1KDM4E
SCHEMBL7827951 0.84 DYRK1A (0.44) DYRK1AABCG2ALDH1A1KDM4EHSD17B10
SCHEMBL7827216 0.83 DYRK1A (0.42) DYRK1AALDH1A1KDM4EHSD17B10MAPT
SCHEMBL7816523 0.82 CHEK1 (0.51) ALDH1A1KDM4EHSD17B10MAPTMEN1
SCHEMBL1115295 0.81 ALDH1A1 (0.48) ALDH1A1KDM4EHSD17B10MAPTMEN1
SCHEMBL7825768 0.81 MAOA (0.47) ALDH1A1KDM4EHSD17B10MEN1KMT2A
SCHEMBL7824147 0.80 KDM4E (0.40) DYRK1AALDH1A1KDM4EMAPTMEN1
SCHEMBL7831835 0.80 CTSV (0.40) ABCG2ALDH1A1KDM4EHSD17B10MEN1

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-0686636-B1 TRICYCLIC BENZAZEPINE AND BENZOTHIAZEPINE DERIVATIVES MEIJI SEIKA CO (JP) 2001-04-04 EP disclosed
EP-0686636-A1 TRICYCLIC BENZAZEPINE AND BENZOTHIAZEPINE DERIVATIVES MEIJI SEIKA KABUSHIKI KAISHA (JP) 1995-12-13 EP disclosed