SCHEMBL8599398

SCHEMBL8599398

CC(C)(C)N(C(=O)ON)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.41
NPSR1 Q6W5P4 3/20 0.41
MEN1 O00255 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
RAB9A P51151 2/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
TDP1 Q9NUW8 2/20 0.39
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MAPT P10636 1/20 0.37
ALDH1A1 P00352 3/20 0.36
TSHR P16473 2/20 0.36
GLA P06280 1/20 0.36
CHRM4 P08173 2/20 0.36
CHRM3 P20309 2/20 0.36
ALOX15 P16050 1/20 0.35
NPC1 O15118 1/20 0.35
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL28261328 0.84 CYP3A4 (0.38) NPSR1RAB9ACYP3A4CYP2C9CYP2C19
SCHEMBL27852885 0.83 ALDH1A1 (0.44) KMT2ANPSR1MEN1SMN1; SMN2RAB9A
SCHEMBL28648791 0.80 MEN1 (0.40) KMT2ANPSR1MEN1SMN1; SMN2RAB9A
SCHEMBL28436400 0.79 TDP1 (0.47) KMT2ANPSR1MEN1SMN1; SMN2RAB9A
SCHEMBL9435677 0.79 KMT2A (0.45) KMT2ANPSR1MEN1SMN1; SMN2RAB9A
SCHEMBL7034982 0.78 KMT2A (0.47) KMT2ANPSR1MEN1SMN1; SMN2RAB9A
SCHEMBL10959895 0.78 NPSR1 (0.50) KMT2ANPSR1MEN1SMN1; SMN2RAB9A
SCHEMBL6626142 0.76 KMT2A (0.46) KMT2ANPSR1MEN1SMN1; SMN2RAB9A
SCHEMBL28779722 0.76 MEN1 (0.40) KMT2ANPSR1MEN1SMN1; SMN2RAB9A
SCHEMBL27492068 0.76 CHRNB2 (0.42) KMT2ANPSR1MEN1SMN1; SMN2RAB9A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0804525-A4 DIMERCAPTOTHIADIAZOLE-MERCAPTAN COUPLED COMPOUNDS AS MULTIFUNCTIONAL ADDITIVES FOR LUBRICANTS AND FUELS MOBIL OIL CORP (US) 1998-09-02 EP disclosed
EP-0804525-A1 DIMERCAPTOTHIADIAZOLE-MERCAPTAN COUPLED COMPOUNDS AS MULTIFUNCTIONAL ADDITIVES FOR LUBRICANTS AND FUELS MOBIL OIL CORPORATION (US) 1997-11-05 EP disclosed
WO-1996006903-A1 DIMERCAPTOTHIADIAZOLE-MERCAPTAN COUPLED COMPOUNDS AS MULTIFUNCTIONAL ADDITIVES FOR LUBRICANTS AND FUELS MOBIL OIL CORPORATION (US) 1996-03-07 WO disclosed