SCHEMBL17674239

SCHEMBL17674239

COC(=O)c1cccnc1[N+](=O)[O-]

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.56
POLB P06746 5/20 0.51
TDP1 Q9NUW8 2/20 0.51
ALDH1A1 P00352 4/20 0.48
MAP2K1 Q02750 1/20 0.48
HTT P42858 2/20 0.47
MAPT P10636 2/20 0.47
ESR2 Q92731 1/20 0.47
KDM4E B2RXH2 5/20 0.47
L3MBTL1 Q9Y468 4/20 0.46
PKM P14618 1/20 0.46
LMNA P02545 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
ATM Q13315 2/20 0.45
TSHR P16473 1/20 0.43
RECQL P46063 1/20 0.43
MCL1 Q07820 1/20 0.43

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
SCHEMBL17673916 0.84 ALDH1A1 (0.45) KMT2APOLBALDH1A1HTTMAPT
SCHEMBL17674161 0.83 L3MBTL1 (0.54) KMT2APOLBALDH1A1HTTMAPT
SCHEMBL20066139 0.82 KMT2A (0.46) KMT2APOLBTDP1ALDH1A1HTT
SCHEMBL32669360 0.81 ALDH1A1 (0.47) KMT2APOLBTDP1ALDH1A1HTT
SCHEMBL8567678 0.81 ALDH1A1 (0.47) KMT2APOLBTDP1ALDH1A1HTT
SCHEMBL17674139 0.80 ALDH1A1 (0.57) KMT2ATDP1ALDH1A1MAPTKDM4E
SCHEMBL8564029 0.80 KDM4E (0.55) KMT2APOLBTDP1ALDH1A1HTT
SCHEMBL12405503 0.79 KMT2A (0.46) KMT2APOLBTDP1ALDH1A1MAP2K1
SCHEMBL11617288 0.78 ALDH1A1 (0.42) KMT2APOLBALDH1A1HTTMAPT
SCHEMBL8560948 0.78 MAPT (0.51) KMT2APOLBALDH1A1HTTMAPT

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
EP-3204429-A1 METHOD FOR PRODUCING POLYDIENES AND POLYDIENE COPOLYMERS WITH REDUCED COLD FLOW Bridgestone Corporation (JP) 2017-08-16 EP claimed
WO-2016057388-A1 METHOD FOR PRODUCING POLYDIENES AND POLYDIENE COPOLYMERS WITH REDUCED COLD FLOW BRIDGESTONE CORPORATION (JP) 2016-04-14 WO claimed
EP-3204429-A1 METHOD FOR PRODUCING POLYDIENES AND POLYDIENE COPOLYMERS WITH REDUCED COLD FLOW Bridgestone Corporation (JP) 2017-08-16 EP disclosed
WO-2016057388-A1 METHOD FOR PRODUCING POLYDIENES AND POLYDIENE COPOLYMERS WITH REDUCED COLD FLOW BRIDGESTONE CORPORATION (JP) 2016-04-14 WO disclosed