SCHEMBL27481968

SCHEMBL27481968

COc1ccc(Cn2nnc(C(=O)O)c2C(O)c2cc(OC)c(OC)cc2[N+](=O)[O-])cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.45
MAPT P10636 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
ALOX15 P16050 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ALDH1A1 P00352 9/20 0.40
KDM4E B2RXH2 7/20 0.40
HSD17B10 Q99714 4/20 0.40
HTT P42858 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
RECQL P46063 1/20 0.40
HPGD P15428 3/20 0.40
RXFP1 Q9HBX9 1/20 0.39
CYP2C19 P33261 2/20 0.39
HSP90AA1 P07900 1/20 0.39
HSP90AB1 P08238 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39

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
SCHEMBL27367023 0.93 POLB (0.41) POLBMAPTSMN1; SMN2NPC1RAB9A
SCHEMBL5515342 0.90 SLC5A1 (0.45) POLBMAPTSMN1; SMN2NPC1RAB9A
SCHEMBL27369607 0.88 MAPT (0.39) POLBMAPTSMN1; SMN2ALOX15L3MBTL1
SCHEMBL27482671 0.86 POLB (0.42) POLBMAPTSMN1; SMN2NPC1RAB9A
SCHEMBL5516696 0.85 SLC5A1 (0.44) POLBMAPTSMN1; SMN2ALDH1A1KDM4E
SCHEMBL8069350 0.85 SLC5A1 (0.44) POLBMAPTSMN1; SMN2ALDH1A1KDM4E
SCHEMBL7828627 0.85 SLC5A1 (0.44) POLBMAPTSMN1; SMN2ALOX15L3MBTL1
SCHEMBL8067119 0.83 SLC5A1 (0.43) POLBMAPTSMN1; SMN2ALOX15L3MBTL1
SCHEMBL7827659 0.81 SLC5A1 (0.43) POLBMAPTSMN1; SMN2ALOX15L3MBTL1
SCHEMBL5519562 0.80 LMNA (0.47) POLBMAPTSMN1; SMN2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100387580-C Tricyclic triazolobenzazepine * derivatives, process for preparing the same, and antiallergic agent MEIJI SEIKA KAISHA (JP) 2008-05-14 CN disclosed
CN-1312135-C Tricyclic triazolobenzazepine * derivatives, process for preparing the same, and antiallergic agent MEIJI SEIKA KAISHA (JP) 2007-04-25 CN disclosed
CN-1781913-A Tricyclic triazolobenzazepine derivatives, process for producing the same, and antiallergic agent MEIJI SEIKA KAISHA (JP) 2006-06-07 CN disclosed
CN-1523019-A Tricyclic triazolobenzazepine * derivatives, process for preparing the same, and antiallergic agent �����Ƹ���ʽ���� 2004-08-25 CN disclosed
CN-1155599-C Tricyclic triazolobenzazepine * derivatives, process for preparing the same, and antiallergic agent �����Ƹ���ʽ���� 2004-06-30 CN disclosed
CN-1278262-A Tricyclic triazolobenzazepine * derivatives, process for preparing the same, and antiallergic agent MEIJI SEIKA KAISHA (JP) 2000-12-27 CN disclosed