SCHEMBL9525680

SCHEMBL9525680

O=C(Nc1ccccc1)Oc1nnc2ccccc2c1O

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.43
ALDH1A1 P00352 2/20 0.43
GAA P10253 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
USP2 O75604 1/20 0.42
MAPT P10636 2/20 0.41
KDM4E B2RXH2 2/20 0.41
THRB P10828 1/20 0.41
RECQL P46063 1/20 0.41
KMT2A Q03164 2/20 0.40
RAB9A P51151 1/20 0.40
HSP90AA1 P07900 1/20 0.40
ADORA3 P0DMS8 3/20 0.40
BLM P54132 1/20 0.40
RAD51 Q06609 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
BCHE P06276 2/20 0.38
ACHE P22303 1/20 0.38

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
SCHEMBL9527795 0.91 POLB (0.44) HTTALDH1A1SMN1; SMN2MAPTRAB9A
SCHEMBL9524999 0.89 RAB9A (0.44) ALDH1A1GAASMN1; SMN2MAPTKDM4E
SCHEMBL9524812 0.87 RAB9A (0.47) ALDH1A1GAAKDM4ERECQLKMT2A
SCHEMBL9527700 0.86 DDX3X (0.44) ALDH1A1SMN1; SMN2MAPTKDM4ETHRB
SCHEMBL9527660 0.86 ALDH1A1 (0.50) ALDH1A1GAASMN1; SMN2MAPTKDM4E
SCHEMBL9525725 0.86 KMT2A (0.49) ALDH1A1GAAKDM4EKMT2ARAB9A
SCHEMBL9523908 0.86 HPGD (0.46) HTTALDH1A1MAPTTHRBRECQL
SCHEMBL9525178 0.86 NPC1 (0.43) HTTALDH1A1GAASMN1; SMN2MAPT
SCHEMBL9524816 0.85 MEN1 (0.41) HTTALDH1A1SMN1; SMN2USP2MAPT
SCHEMBL9524870 0.84 CSF1R (0.45) HTTALDH1A1GAASMN1; SMN2MAPT

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-0277791-B1 CINNOLINE-CARBOXAMIDES AND PROCESS FOR THEIR PREPARATION FARMITALIA CARLO ERBA S.r.l. (IT) 1993-06-02 EP claimed