SCHEMBL8475744

SCHEMBL8475744

CCOC(=O)NN=C(N)OC

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.43
RAB9A P51151 1/20 0.42
GAA P10253 2/20 0.41
MAPT P10636 3/20 0.40
ALDH1A1 P00352 3/20 0.40
HPGD P15428 2/20 0.40
MIF P14174 1/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
CYP1A2 P05177 4/20 0.38
CYP2C19 P33261 2/20 0.38
MGAM O43451 1/20 0.38
SI P14410 1/20 0.38
MGAM2 Q2M2H8 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
PKM P14618 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
CYP2C9 P11712 1/20 0.37

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
SCHEMBL28349630 0.83 ALOX15 (0.46) ALOX15RAB9AGAAMAPTALDH1A1
SCHEMBL8481002 0.83 RAB9A (0.39) ALOX15RAB9AGAAMAPTALDH1A1
SCHEMBL16418041 0.77 RAB9A (0.40) ALOX15RAB9AGAAMAPTALDH1A1
SCHEMBL4659997 0.77 RAB9A (0.49) RAB9AGAAMAPTALDH1A1HPGD
SCHEMBL3522854 0.75 RAB9A (0.47) RAB9AGAAMAPTALDH1A1HPGD
SCHEMBL3517357 0.75 RAB9A (0.47) RAB9AGAAMAPTALDH1A1HPGD
SCHEMBL3522852 0.75 RAB9A (0.47) RAB9AGAAMAPTALDH1A1HPGD
SCHEMBL8849951 0.74 RAB9A (0.41) RAB9AGAAMAPTALDH1A1HPGD
SCHEMBL9523126 0.73 MAPT (0.43) RAB9AGAAMAPTALDH1A1HPGD
SCHEMBL10343768 0.73 RAB9A (0.46) RAB9AGAAMAPTALDH1A1HPGD

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
US-5710303-A Process for the preparation of alkoxytriazolinones BAYER AKTIENGESELLSCHAFT (DE) 1998-01-20 US claimed
US-5892054-A Process for the preparation of alkoxytriazolinones BAYER AKTIENGESELLSCHAFT (DE) 1999-04-06 US disclosed
US-5710303-A Process for the preparation of alkoxytriazolinones BAYER AKTIENGESELLSCHAFT (DE) 1998-01-20 US disclosed
US-5599945-A Process for the preparation of alkoxytriazolinones BAYER AKTIENGESELLSCHAFT (DE) 1997-02-04 US disclosed