SCHEMBL8091150

SCHEMBL8091150

CCCCCC1(F)C(=O)Nc2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.46
PDK4 Q16654 1/20 0.46
MMP2 P08253 4/20 0.43
MMP9 P14780 4/20 0.43
MMP3 P08254 1/20 0.43
GAA P10253 3/20 0.43
MGAM O43451 2/20 0.43
SI P14410 2/20 0.43
MGAM2 Q2M2H8 2/20 0.43
MMP8 P22894 2/20 0.42
MMP13 P45452 2/20 0.42
POLB P06746 1/20 0.40
HTR7 P34969 3/20 0.40
LMNA P02545 1/20 0.40
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL5486391 0.81 MMP2 (0.55) PDK2PDK4MMP2MMP9MMP8
SCHEMBL25927823 0.79 MMP2 (0.54) PDK2PDK4MMP2MMP9MMP8
SCHEMBL250063 0.79 GAA (0.54) PDK2PDK4MMP2MMP9MMP3
SCHEMBL28331938 0.78 PDK2 (0.46) PDK2PDK4MMP2MMP9MMP3
SCHEMBL28140642 0.76 MMP2 (0.50) PDK2PDK4MMP2MMP9MMP8
SCHEMBL25927798 0.76 HTR7 (0.51) PDK2PDK4MMP2MMP9GAA
SCHEMBL28373509 0.75 PDK2 (0.48) PDK2PDK4GAAMGAMSI
SCHEMBL10369216 0.74 GAA (0.55) PDK2PDK4GAAMGAMSI
SCHEMBL10607545 0.74 MMP2 (0.39) PDK2PDK4MMP2MMP9MMP3
SCHEMBL25927782 0.73 HTR7 (0.49) PDK2PDK4MMP2MMP9GAA

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-0747354-B1 3-Substituted oxindole derivatives as potassium channel modulators BRISTOL MYERS SQUIBB CO (US) 2000-08-16 EP disclosed
US-5602169-A USEFUL IN REDUCING NEURONAL DAMAGE DURING ISCHEMIC STROKE BRISTOL-MYERS SQUIBB COMPANY (US) 1997-02-11 US disclosed
EP-0747354-A1 3-Substituted oxindole derivatives as potassium channel modulators BRISTOL-MYERS SQUIBB COMPANY (US) 1996-12-11 EP disclosed
US-5565483-A ADMINISTERING AS THERAPY FOR ISCHEMIA, CONVULSIONS OR ASTHMA BRISTOL-MYERS SQUIBB COMPANY (US) 1996-10-15 US disclosed