SCHEMBL8895162

SCHEMBL8895162

CCCCCCCCCCNC(=N)NC(=N)NCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.54
NAAA Q02083 3/20 0.49
HPGD P15428 1/20 0.49
HDAC3 O15379 3/20 0.47
FAAH O00519 1/20 0.47
EPHX1 P07099 3/20 0.47
ALDH1A1 P00352 1/20 0.47
HTT P42858 1/20 0.47
TLR2 O60603 1/20 0.46
SIGMAR1 Q99720 1/20 0.45

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
SCHEMBL13584685 1.00 EPHX2 (0.54) EPHX2NAAAHPGDHDAC3FAAH
SCHEMBL8895173 1.00 EPHX2 (0.54) EPHX2NAAAHPGDHDAC3FAAH
Hydrochloric Acid SCHEMBL8896288 0.98 EPHX2 (0.52) EPHX2NAAAHPGDHDAC3FAAH
Hydrochloric Acid SCHEMBL8896452 0.98 EPHX2 (0.52) EPHX2NAAAHPGDHDAC3FAAH
Hydrochloric Acid SCHEMBL4473390 0.98 EPHX2 (0.52) EPHX2NAAAHPGDHDAC3FAAH
Hydrochloric Acid SCHEMBL13584812 0.98 EPHX2 (0.52) EPHX2NAAAHPGDHDAC3FAAH
Hydrochloric Acid SCHEMBL4485174 0.98 EPHX2 (0.52) EPHX2NAAAHPGDHDAC3FAAH
Hydrochloric Acid SCHEMBL4471284 0.98 EPHX2 (0.52) EPHX2NAAAHPGDHDAC3FAAH
Hydrochloric Acid SCHEMBL4479212 0.98 EPHX2 (0.52) EPHX2NAAAHPGDHDAC3FAAH
SCHEMBL17289522 0.94 EPHX2 (0.52) EPHX2NAAAHPGDHDAC3FAAH

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-0507317-B1 Biguanide derivatives, manufacturing method thereof, and disinfectants containing the derivatives OTSUKA PHARMA CO LTD (JP) 1997-01-15 EP claimed
EP-0507317-A2 Biguanide derivatives, manufacturing method thereof, and disinfectants containing the derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1992-10-07 EP claimed
EP-0507317-B1 Biguanide derivatives, manufacturing method thereof, and disinfectants containing the derivatives OTSUKA PHARMA CO LTD (JP) 1997-01-15 EP disclosed
EP-0507317-A2 Biguanide derivatives, manufacturing method thereof, and disinfectants containing the derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1992-10-07 EP disclosed