SCHEMBL9675014

SCHEMBL9675014

CCC(=NO)c1c(C)nn(C)c1Oc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.49
MAPT P10636 1/20 0.49
ALDH1A1 P00352 3/20 0.45
KMT2A Q03164 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.42
GAA P10253 1/20 0.42
GPBAR1 Q8TDU6 1/20 0.41
SMN1; SMN2 Q16637 4/20 0.39
LMNA P02545 3/20 0.39
HTT P42858 2/20 0.39
ABCB1 P08183 2/20 0.38
PTGER4 P35408 1/20 0.38
CYP1A2 P05177 2/20 0.36
CYP2C9 P11712 2/20 0.36
CYP2C19 P33261 2/20 0.36
CYP3A4 P08684 1/20 0.36
PDE4D Q08499 1/20 0.36

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
SCHEMBL9674883 0.82 KDM4E (0.52) KDM4EMAPTALDH1A1KMT2AL3MBTL1
SCHEMBL9672375 0.80 KDM4E (0.50) KDM4EMAPTALDH1A1KMT2AL3MBTL1
SCHEMBL10567354 0.80 KDM4E (0.56) KDM4EMAPTALDH1A1KMT2AL3MBTL1
SCHEMBL9674754 0.76 KDM4E (0.62) KDM4EMAPTALDH1A1KMT2AL3MBTL1
SCHEMBL30995709 0.73 ALDH1A1 (0.57) KDM4EMAPTALDH1A1KMT2AL3MBTL1
SCHEMBL9262039 0.71 SMN1; SMN2 (0.50) KDM4EMAPTALDH1A1KMT2AL3MBTL1
SCHEMBL9262044 0.71 SMN1; SMN2 (0.50) KDM4EMAPTALDH1A1KMT2AL3MBTL1
SCHEMBL9674507 0.71 SMN1; SMN2 (0.50) KDM4EMAPTALDH1A1KMT2AL3MBTL1
SCHEMBL9673127 0.68 KDM4E (0.41) KDM4EMAPTALDH1A1KMT2AL3MBTL1
SCHEMBL876883 0.68 MAPT (0.79) KDM4EMAPTALDH1A1KMT2AL3MBTL1

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-0234045-B1 A PYRAZOLE OXIME DERIVATIVE AND ITS PRODUCTION AND USE NIHON NOHYAKU CO., LTD. (JP) 1992-09-02 EP disclosed
EP-0234045-A2 A pyrazole oxime derivative and its production and use NIHON NOHYAKU CO., LTD. (JP) 1987-09-02 EP disclosed